Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987_Cu__MO_179025990738_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.615000084042549
cohesive_energy=3.5196298154797776
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[8.052011044194779e-20, 1.7625545150634e-19, 2.4334499587845597e-19, 2.9575219357659597e-19, 3.3910068458609996e-19, 3.76115771361402e-19, 4.08151293158232e-19, 4.3505504319635995e-19, 4.568526563019299e-19, 4.739735158128539e-19, 4.87837150226856e-19, 4.999592186396999e-19, 5.110142374142999e-19, 5.2097176519461e-19, 5.29796554094682e-19, 5.37496614997686e-19, 5.44102389259668e-19, 5.4965713564974595e-19, 5.542121238202079e-19, 5.57820225599976e-19, 5.6053751717124e-19, 5.62416870362922e-19, 5.635095548273099e-19, 5.6386203368679e-19, 5.63447069938584e-19, 5.6194743260916e-19, 5.589353405372399e-19, 5.539061080831139e-19, 5.46258919009032e-19, 5.352808047128639e-19, 5.201290202851259e-19, 4.9994319687336e-19, 4.75107856869726e-19, 4.46941591644006e-19, 4.17067406126442e-19, 3.8594031848109e-19, 3.5272078815173397e-19, 3.16292098024476e-19, 2.7521389130535e-19, 2.27206270644174e-19, 1.6861627331542796e-19, 9.45417194720622e-20, -9.95869736925282e-22, -1.195962372392274e-19, -2.60877614784318e-19, -4.33728440943408e-19, -6.5884387108021205e-19, -9.60115563160938e-19, -1.329628764613626e-18, -1.8066143724983998e-18, -2.4834859350643798e-18, -3.56223146273658e-18, -5.12646855404346e-18, -7.946411582247839e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.013573699126419208
Energy: 0.014061293165358505
Energy: 0.013958296958244219
Energy: 0.013840608157196465
Energy: 0.5826429678660972
Energy: 0.013963797325105033
Energy: 0.014061293165044899
Energy: 0.10350102713020487
Energy: 0.10354523145977194
Energy: 0.10352458983253744
Energy: 0.1036604579075901
Energy: 0.1035035085442611
Energy: 0.013958296958244219
Energy: 0.1035452314600507
Energy: 0.10349254147372976
Energy: 0.013904982890766514
Energy: 0.10353301274817603
Energy: 0.1035109553386429
Energy: 0.013840608157196465
Energy: 0.10352458983285104
Energy: 0.013904982890452909
Energy: 0.013856484265172239
Energy: 0.10359313634468618
Energy: 0.0139893901127989
Energy: 0.5826429678651912
Energy: 0.10366045790696286
Energy: 0.1035330127506152
Energy: 0.10359313634590576
Energy: 0.10346669026142837
Energy: 0.10378472979419816
Energy: 0.013963797324826272
Energy: 0.1035035085442611
Energy: 0.1035109553386429
Energy: 0.0139893901127989
Energy: 0.10378472979482536
Energy: 0.014381920048785066

minimum gb energy = 0.013573699126419208 eV
minimum distance =  2.5504077766603 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.4315252706421324
Energy: 0.9511867378629526
Energy: 0.9425569704928392
Energy: 0.9201737325571662
Energy: 0.9762236182015238
Energy: 0.9424307999961379
Energy: 1.405860457219785
Energy: 0.9141292853153467
Energy: 0.887787654867077
Energy: 0.8859682693584797
Energy: 0.9469730643388572
Energy: 0.9007745640933401
Energy: 1.2434652057552769
Energy: 0.8944422618533847
Energy: 0.8713188556547384
Energy: 0.9037272985051303
Energy: 0.9381008717485577
Energy: 0.9032422759350149
Energy: 1.5710469223751693
Energy: 0.9158029421888249
Energy: 0.8862907074519661
Energy: 0.8957162652129677
Energy: 0.9114735750564287
Energy: 0.9102338916482938
Energy: 1.3740596740598914
Energy: 0.8900978949838757
Energy: 0.8978242831530983
Energy: 0.8840698381549182
Energy: 0.8993118842306452
Energy: 0.9044392191423613
Energy: 1.288665093609423
Energy: 0.9090020544919236
Energy: 0.9090384331427076
Energy: 0.891523116960264
Energy: 0.8965458317675976
Energy: 0.9114688325814237
Energy: 1.2894892462010155
Energy: 0.908769071148565
Energy: 0.9092978467078069
Energy: 0.8894972258212445
Energy: 0.8877631323826517
Energy: 0.9101635843109717
Energy: 1.2339121312556003
Energy: 0.8732299568541384
Energy: 0.8998827370932949
Energy: 0.8298363853838773
Energy: 0.8837823307001238
Energy: 0.9077583232685412
Energy: 0.9924446908084621
Energy: 0.8933253658819108
Energy: 0.9046322669126379
Energy: 0.896978852914062
Energy: 0.8890599655586896
Energy: 0.9078954013712328
Energy: 0.9969052951152569
Energy: 0.9009018214676923
Energy: 0.9004800120360235
Energy: 0.8992677242056184
Energy: 0.8979221303087722
Energy: 0.8963746011334564
Energy: 1.0269612469638676
Energy: 0.8576750658371564
Energy: 0.8579733803674263
Energy: 0.9539795240016418
Energy: 0.9061430291423882
Energy: 0.8951251539041681
Energy: 0.9373222172965441
Energy: 0.9014996220129873
Energy: 0.9060869316412726
Energy: 0.9375006603861719
Energy: 0.8831327958667152
Energy: 0.8940661310418399
Energy: 0.9468658957127658
Energy: 0.8865782066910849
Energy: 0.8934044094648553
Energy: 0.9468526117948627
Energy: 0.8878107952938215
Energy: 0.9067222748497266
Energy: 1.0401392096013151
Energy: 0.8742492188319766
Energy: 0.8667039893966272
Energy: 0.9669938420602573
Energy: 0.8938365836606896
Energy: 0.9261823239352907
Energy: 0.9470676928437005
Energy: 0.8849949396063161
Energy: 0.8981625661823575
Energy: 0.9132349182929705
Energy: 0.8843263545320971
Energy: 0.8973039934869691
Energy: 0.9465250312487579
Energy: 0.9072005646935308
Energy: 0.8856398472928934
Energy: 0.9091574972408395
Energy: 0.9068209520518077
Energy: 0.9114637577635742
Energy: 1.2485779509227655
Energy: 0.8983929329542523
Energy: 0.9048502382037944
Energy: 0.8878282589764215
Energy: 0.8977338493978584
Energy: 0.910622290010489
Energy: 1.1297673740997305
Energy: 0.9048292205506319
Energy: 0.9054814879432145
Energy: 0.8945872078125101
Energy: 0.8894037225980141
Energy: 0.9049235346295774
Energy: 1.1298798940500427
Energy: 0.9062350229051083
Energy: 0.9066151526877989
Energy: 0.8925598479743023
Energy: 0.8902359108529561
Energy: 0.9065389277228957
Energy: 1.2713471118421844
Energy: 0.9059181764227077
Energy: 0.9081326047999246
Energy: 0.8898406412750853
Energy: 0.8910801005123667
Energy: 0.90680324225189
Energy: 1.4434302520859286
Energy: 0.8879849748075802
Energy: 0.8608874310836645
Energy: 0.9071545956598418
Energy: 0.8824417273716707
Energy: 0.8604511966377051
Energy: 1.327050446732764
Energy: 0.9103245514133413
Energy: 0.8977292102285963
Energy: 0.8997677239719385
Energy: 0.9266329107579905
Energy: 0.8916076726871552
Energy: 1.4058908024831527
Energy: 0.9137874335142633
Energy: 0.890490360883181
Energy: 0.8939892155090787
Energy: 0.9142514818107829
Energy: 0.901745850441645

minimum gb energy = 0.8298363853838773 eV
minimum distance =  2.36967588742604 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.7320195638683236
Energy: 1.0392417279811483
Energy: 1.0414941295638227
Energy: 1.0199397769025493
Energy: 1.0214037970812917
Energy: 1.116436366765821
Energy: 1.2587894077820194
Energy: 0.9636960416447158
Energy: 0.940232003457145
Energy: 0.9504850510205975
Energy: 0.9457022472756241
Energy: 0.9653028844218121
Energy: 1.3725618231260066
Energy: 0.974501553587948
Energy: 0.9719056913870529
Energy: 0.9721745588921886
Energy: 0.9740963057773451
Energy: 0.9669639986712316
Energy: 1.4461336650757437
Energy: 1.0030500480996243
Energy: 0.9476987668884335
Energy: 0.9542847714259134
Energy: 0.9420545292228378
Energy: 0.9536843025625255
Energy: 1.307105787721706
Energy: 1.0426126417952817
Energy: 0.9561952701812706
Energy: 0.952972071367063
Energy: 0.9817440391530905
Energy: 1.0178425940379676
Energy: 1.343908934897482
Energy: 0.9456802765914387
Energy: 1.0053425733411852
Energy: 1.0282629929867864
Energy: 1.0247698300514525
Energy: 1.0075770282187402
Energy: 1.3447809724865147
Energy: 0.9672245167717507
Energy: 0.9677227779800827
Energy: 1.0082152802108244
Energy: 0.9672528806595686
Energy: 0.9657943751938352
Energy: 1.2576107130462701
Energy: 0.9680985680744554
Energy: 0.9681947645341265
Energy: 0.9452374925875033
Energy: 0.9680562638594904
Energy: 0.9683998387658787
Energy: 1.0821623586297622
Energy: 0.9683306444119114
Energy: 1.0022984500623455
Energy: 1.0183598618421708
Energy: 0.9686042820527159
Energy: 1.0055606922217053
Energy: 1.0963053740506397
Energy: 1.008417316452428
Energy: 0.9993061403919136
Energy: 0.949937706914932
Energy: 1.0032602667092412
Energy: 0.9910908628651478
Energy: 1.1019442565292599
Energy: 0.8911055000129364
Energy: 0.8908947106921944
Energy: 1.0448482116634688
Energy: 0.8914524448660686
Energy: 0.890725754557218
Energy: 1.0288649478004268
Energy: 0.9266920988148516
Energy: 0.9887710978667829
Energy: 0.9934929680486635
Energy: 0.9262260539120255
Energy: 0.9601124843320781
Energy: 1.034639547748288
Energy: 0.9992575467690601
Energy: 0.9998179220379354
Energy: 1.024295444420192
Energy: 1.0002362006876824
Energy: 0.9678680188524812
Energy: 1.1240248407933233
Energy: 0.9540827170132723
Energy: 0.953820785868133
Energy: 1.0244889648354483
Energy: 0.953824799047534
Energy: 0.9535333616605702
Energy: 1.134773584723425
Energy: 0.9920759464754282
Energy: 0.9951222092891933
Energy: 1.0406435893623343
Energy: 0.9976158805477372
Energy: 0.9730578819280629
Energy: 1.1023525838352715
Energy: 1.0250621125066754
Energy: 1.0052770550489858
Energy: 1.0235058394672714
Energy: 1.0188531624883055
Energy: 1.0043503842770245
Energy: 1.3058522669621342
Energy: 0.9975612403226539
Energy: 0.9956696132183561
Energy: 1.0005963473949695
Energy: 0.9984152842403268
Energy: 0.9953438026667011
Energy: 1.1783924540745094
Energy: 1.0086717437939534
Energy: 1.022517209175418
Energy: 0.9681251232379651
Energy: 1.018402874901341
Energy: 0.9685081022245576
Energy: 1.1940641812400008
Energy: 1.0135247894813046
Energy: 1.0098264725964623
Energy: 0.9684247654782401
Energy: 1.0202382228639957
Energy: 1.0115683883174336
Energy: 1.368313748310657
Energy: 1.0247584690601614
Energy: 1.0227809754129746
Energy: 1.00071124392258
Energy: 1.0179302297033492
Energy: 1.0221323391742245
Energy: 1.5322317991800076
Energy: 1.0155638135480873
Energy: 0.9690532023441626
Energy: 0.9719406913443142
Energy: 1.0031739083180469
Energy: 0.9689578145213644
Energy: 1.255900021040121
Energy: 1.011369909760555
Energy: 1.010997737908021
Energy: 0.9993393765151687
Energy: 1.0069425337088302
Energy: 0.9911455827770719
Energy: 1.3056141585170506
Energy: 1.0234162699991565
Energy: 1.0215386289173962
Energy: 0.9687697157080418
Energy: 1.0240996744097979
Energy: 1.0117524558635393
Energy: 1.4403162713625015
Energy: 1.0701868660968834
Energy: 1.0176317153392636
Energy: 1.0387299125777276
Energy: 1.0847647500815558
Energy: 0.9427275449859741
Energy: 1.358082824935087
Energy: 1.0296031106865264
Energy: 1.0269337199511588
Energy: 1.0226048512683548
Energy: 1.0400576185649268
Energy: 1.0002044310702554
Energy: 1.3593088129801079
Energy: 1.0232239300628876
Energy: 1.0099829212598708
Energy: 1.0371665145715523
Energy: 1.013330607716417
Energy: 1.0115215533410047
Energy: 1.3562621534835821
Energy: 0.9601055831056837
Energy: 0.970834014897179
Energy: 1.0207755350463246
Energy: 0.96057139768198
Energy: 0.9676802945847706
Energy: 1.2828073769800303
Energy: 0.9683410663260333
Energy: 0.9683139086440903
Energy: 1.0329109516821293
Energy: 0.9683055728693813
Energy: 1.0100918805604457
Energy: 1.0825059930154406
Energy: 0.9683859659250338
Energy: 0.9682882336003135
Energy: 1.0235829088677857
Energy: 0.9681713208380593
Energy: 1.00879673625037
Energy: 1.0826745032365894
Energy: 1.00047073570277
Energy: 0.9978638256102252
Energy: 0.9947603926108598
Energy: 1.0033771792487638
Energy: 1.0005150477033387
Energy: 1.1024440575258532
Energy: 0.8911411721804275
Energy: 0.8903068572896837
Energy: 1.0001509623729783
Energy: 0.8916065518700937
Energy: 0.8901933978198838
Energy: 1.0280484578896452
Energy: 0.9265294803467519
Energy: 0.8959225015997706
Energy: 0.9895882636269512
Energy: 0.9265543561065422
Energy: 0.9694271590034491
Energy: 1.034368626516279
Energy: 0.9944224140134256
Energy: 0.9954514415251494
Energy: 1.0014514464647102
Energy: 0.9934990263712284
Energy: 0.946012389220717
Energy: 1.0314198769149947
Energy: 0.9392450767124209
Energy: 0.953391710587056
Energy: 1.0099497268702675
Energy: 0.9540597609688999
Energy: 0.9526977307535215
Energy: 1.138694152899737
Energy: 0.9908650654294553
Energy: 0.9882051833012956
Energy: 1.0395715162018007
Energy: 0.9463850843558491
Energy: 0.967590629166086
Energy: 1.0853253806570777
Energy: 1.0231030911193326
Energy: 1.018875320382139
Energy: 1.017852541949078
Energy: 1.0347569325779447
Energy: 1.0007534853010838
Energy: 1.0953422448852908
Energy: 1.0080886294216844
Energy: 0.9364354115449951
Energy: 0.9642682758051903
Energy: 0.9367091590163714
Energy: 0.9387942432192605
Energy: 1.1931759542673606
Energy: 1.0267932247653389
Energy: 0.9586318945519586
Energy: 0.9686562500695255
Energy: 0.9601403632596762
Energy: 1.0281673564900233
Energy: 1.1787749191107797
Energy: 0.9502870860801005
Energy: 0.9585579704481099
Energy: 0.9680851714207639
Energy: 0.9658097603174419
Energy: 0.9682811970546096
Energy: 1.2856273130402085
Energy: 0.9733344134910759
Energy: 0.9567853921044956
Energy: 0.9482110214911049
Energy: 0.9511091787720466
Energy: 0.9610230593297836
Energy: 1.29956348444337
Energy: 0.9563518973195538
Energy: 0.9156457585851155
Energy: 0.9110272785531423
Energy: 0.9533268871949646
Energy: 0.9278893076594829

minimum gb energy = 0.8901933978198838 eV
minimum distance =  2.36426353645817 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.4930945148272952
Energy: 1.0654781232955646
Energy: 1.3014468268887713
Energy: 0.9636396751734164
Energy: 0.9529599419129086
Energy: 0.9810501837655332
Energy: 1.3387333722362045
Energy: 0.9521173750987004
Energy: 0.91895640559641
Energy: 0.9351117056951174
Energy: 0.9523506308282922
Energy: 0.9542636727159153
Energy: 1.232067784516659
Energy: 0.9480298534662761
Energy: 0.920982403902146
Energy: 0.9256074106875843
Energy: 0.948335123693699
Energy: 0.9488820094202681
Energy: 1.3422116434789593
Energy: 0.9202582748182406
Energy: 0.9206416898407052
Energy: 0.9320573128769432
Energy: 0.9207752548445884
Energy: 0.931598540885714
Energy: 1.1961986447652382
Energy: 0.959203604779242
Energy: 0.9586554239090089
Energy: 0.9299129721695807
Energy: 0.95884118497876
Energy: 0.9279280945481856
Energy: 1.0924155564071985
Energy: 0.9590701544397594
Energy: 0.9523788787361868
Energy: 0.958692475415182
Energy: 0.9591505120594654
Energy: 0.9567846470514959
Energy: 1.0924942660725177
Energy: 0.9350545265299162
Energy: 0.9350315090512191
Energy: 0.958607429239398
Energy: 0.9243597681942078
Energy: 0.9240055888459242
Energy: 1.2891692960178265
Energy: 0.9097418211947349
Energy: 0.907998631046123
Energy: 0.9232894596225985
Energy: 0.9134205295276644
Energy: 0.9082103176609455
Energy: 0.9476818723354739
Energy: 0.914478331220279
Energy: 0.9145673502699501
Energy: 0.9477391622887961
Energy: 0.9145977908415863
Energy: 0.948950376142281
Energy: 0.9522331441947738
Energy: 0.9360046793962165
Energy: 0.9526687827561328
Energy: 0.9520766905690283
Energy: 0.9354057895839
Energy: 0.9263599752422431
Energy: 0.9844974341356446
Energy: 0.9125072431146869
Energy: 0.9111747242091447
Energy: 0.9845685412398244
Energy: 0.9126912916290693
Energy: 0.9114898648192533
Energy: 0.9603124822371615
Energy: 0.9353823014767075
Energy: 0.9440050874351117
Energy: 0.9253332592309554
Energy: 0.9200784166789603
Energy: 0.9493019570419671
Energy: 0.9581745637310595
Energy: 0.9392783206925371
Energy: 0.9372817420747827
Energy: 0.9433286276463108
Energy: 0.9450641678871698
Energy: 0.9369628849957526
Energy: 0.9607256835798597
Energy: 0.9376637404027923
Energy: 0.9355886537118985
Energy: 0.9467934940543764
Energy: 0.9378125223895073
Energy: 0.9342141588700632
Energy: 1.254395565510036
Energy: 0.9344745183994632
Energy: 0.9359859183840976
Energy: 0.9452866225956348
Energy: 0.9370939489522071
Energy: 0.9421280248037621
Energy: 1.184367731352918
Energy: 0.9381049899168163
Energy: 0.9340478099383634
Energy: 0.9451975592303082
Energy: 0.9468959660371086
Energy: 0.9445292234861145
Energy: 1.198234958076831
Energy: 0.9471584266395215
Energy: 0.9378811422369465
Energy: 0.9282330455576205
Energy: 0.9458455912670444
Energy: 0.9389571480416571
Energy: 1.4919960033764057
Energy: 0.918678174952692
Energy: 0.9432573598716121
Energy: 0.9110838016940106
Energy: 0.9252598859281767
Energy: 0.9554863521183803

minimum gb energy = 0.907998631046123 eV
minimum distance =  2.37649926358299 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.245040702567211
Energy: 0.8715959878637013
Energy: 0.8590425987393403
Energy: 0.8710233874002313
Energy: 0.8208397249158914
Energy: 0.8626088339606973
Energy: 1.151219930981343
Energy: 0.8379637966637773
Energy: 0.837716911763115
Energy: 0.870430201778583
Energy: 0.8378205583104273
Energy: 0.8381627468022439
Energy: 0.9595497857337277
Energy: 0.8376983017652887
Energy: 0.8377115626892774
Energy: 0.8703992513019492
Energy: 0.8378269180593658
Energy: 0.8383199593977446
Energy: 1.0263181801947026
Energy: 0.8380315022839248
Energy: 0.8374867821062983
Energy: 0.9216398335180335
Energy: 0.8382958256611031
Energy: 0.838013185068076
Energy: 0.958764195578005
Energy: 0.8380206590895707
Energy: 0.8697013187064537
Energy: 0.8209610594125805
Energy: 0.8372871369449558
Energy: 0.8692217983140929
Energy: 1.0455642955240978
Energy: 0.8099828583294771
Energy: 0.8687537956370293
Energy: 0.8706390185829964
Energy: 0.8098130894765625
Energy: 0.8671304963442195
Energy: 1.0478402194805954
Energy: 0.8210080669490867
Energy: 0.8238767623762516
Energy: 0.8697423339016133
Energy: 0.8208753442992426
Energy: 0.8684298914984844
Energy: 0.95771699574968
Energy: 0.8110719800884946
Energy: 0.8110154127103649
Energy: 0.8375168862879101
Energy: 0.8219259248919745
Energy: 0.8105668124826442
Energy: 0.8374569291936798
Energy: 0.8110542477606101
Energy: 0.8105776223443044
Energy: 0.8374190798141736
Energy: 0.8103630966848103
Energy: 0.8101724417835792
Energy: 0.8376000361746186
Energy: 0.8694345367479477
Energy: 0.9252946073994326
Energy: 0.8376977312375883
Energy: 0.8213013966954986
Energy: 0.8378513872506227
Energy: 0.8352279927312507
Energy: 0.9212688984524842
Energy: 0.8650266033705349
Energy: 0.8369292795570286
Energy: 0.921783677709026
Energy: 0.8378175372955041
Energy: 1.0459348868781324
Energy: 0.8694771594114263
Energy: 0.8697667519450661
Energy: 0.8376489668423182
Energy: 0.821445646417671
Energy: 0.8383642635611933
Energy: 0.8087273985566631
Energy: 0.8691883988885907
Energy: 0.8700662151698838
Energy: 0.8096425814316516
Energy: 0.8699273465217622
Energy: 0.8693345436496192
Energy: 0.9578932767568038
Energy: 0.8702289434915055
Energy: 0.8699542944618649
Energy: 0.8376097993735014
Energy: 0.8692409492855909
Energy: 0.8695506225918141
Energy: 1.151877235028921
Energy: 0.8375344612167598
Energy: 0.838653376399304
Energy: 0.8105732885064199
Energy: 0.8373613787291757
Energy: 0.8103909646454172
Energy: 1.2530278497087164
Energy: 0.8385563013195148
Energy: 0.8108148168224807
Energy: 0.8214760406272974
Energy: 0.838083366746089
Energy: 0.8109230213175397
Energy: 0.9572193660294316
Energy: 0.8377473403824441
Energy: 0.8377621820597722
Energy: 0.8216720465494374
Energy: 0.8375217960141841
Energy: 0.8383881290424845
Energy: 1.0256769242322077
Energy: 0.8375474804776856
Energy: 0.8375302736277239
Energy: 0.8650790248176766
Energy: 0.8374689280272495
Energy: 0.8378966924189181
Energy: 1.025493430916762
Energy: 0.8375935059510888
Energy: 0.8376131310545036
Energy: 0.8652702714463666
Energy: 0.8375393024189869
Energy: 0.8381362566943141
Energy: 0.9592676374693787
Energy: 0.8099861116309585
Energy: 0.8691322000163867
Energy: 0.8210960750491376
Energy: 0.8097790692155217
Energy: 0.8680841571296465
Energy: 1.0376694177942378
Energy: 0.837861589815336
Energy: 0.8695657981399362
Energy: 0.8698013336138735
Energy: 0.8376494895201408
Energy: 0.8698599517629454
Energy: 1.04950932525461
Energy: 0.8212758306297635
Energy: 0.8213142180194836
Energy: 0.8377013716859347
Energy: 0.821104376442178
Energy: 0.8696406681459958
Energy: 0.8214859346127561
Energy: 0.8166830532904887
Energy: 0.8164858784033893
Energy: 0.8213842639152521
Energy: 0.8221658712773386
Energy: 0.8106712248401786
Energy: 0.8376498863106778
Energy: 0.8686139212804518
Energy: 0.8694213484575987
Energy: 0.8376570877867314
Energy: 0.8531094704741482
Energy: 0.8385465077060368
Energy: 0.8378467081888077
Energy: 0.8697403589230471
Energy: 0.8389289135394981
Energy: 0.8379157731941096
Energy: 0.8700035794663203
Energy: 0.8378026995478605
Energy: 0.8210346635902208
Energy: 0.8650275241542882
Energy: 0.8650662696606365
Energy: 0.8210848530326827
Energy: 0.8649649126440374
Energy: 0.8378654089910693
Energy: 1.0508192843757769
Energy: 0.8697529633559283
Energy: 0.8690675286784034
Energy: 0.837213400090079
Energy: 0.8216908654621806
Energy: 0.8696122314650336
Energy: 0.8097834881745137
Energy: 0.8694847839936685
Energy: 0.8692213665291978
Energy: 0.8098022139776504
Energy: 0.8699692726127711
Energy: 0.8683777552842247
Energy: 0.9595229731429308
Energy: 0.8694868358788514
Energy: 0.8694158283865314
Energy: 0.820733552812181
Energy: 0.8697193661085065
Energy: 0.8685432538377728
Energy: 1.2545069936035225
Energy: 0.8395102086479814
Energy: 0.8104438048591396
Energy: 0.8212777928590596
Energy: 0.837996190694047
Energy: 0.8106094453047878

minimum gb energy = 0.8087273985566631 eV
minimum distance =  2.40959903868905 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.0440971766837301
Energy: 0.9704423473452483
Energy: 1.1091369941525548
Energy: 0.8677906783203925
Energy: 0.9441826444041796
Energy: 1.113406158618504
Energy: 0.9183891025687503
Energy: 0.906357036277288
Energy: 0.8474632864651085
Energy: 0.8958011059708759
Energy: 0.9060326905613697
Energy: 0.8522124129125145
Energy: 0.9434124706560125
Energy: 0.9304110280652366
Energy: 0.9016316793994928
Energy: 0.9000818303168316
Energy: 0.9307642042770218
Energy: 0.8530542807015205
Energy: 1.2371994330637477
Energy: 0.9069727604539931
Energy: 0.8562513617774374
Energy: 0.8696226658824161
Energy: 0.9589675927725403
Energy: 0.8537472986614812
Energy: 1.0477395692135365
Energy: 0.8054971871002118
Energy: 0.8567966460623839
Energy: 0.92454898830256
Energy: 0.8047489440890145
Energy: 0.8568025095295443
Energy: 0.9316506097805299
Energy: 0.8125068904187918
Energy: 0.818151297768609
Energy: 0.9324803418095879
Energy: 0.8176443061844952
Energy: 0.8050804190812536
Energy: 0.9225157938280407
Energy: 0.8533240129026528
Energy: 0.8524170150196088
Energy: 0.9226966302450444
Energy: 0.8966836013428034
Energy: 0.8522881480825288
Energy: 0.9747561076830277
Energy: 0.8574710684691058
Energy: 0.8406634462467315
Energy: 0.9434483020761524
Energy: 0.8579110688914986
Energy: 0.8394947988775232
Energy: 0.9429382906106445
Energy: 0.8903271841204073
Energy: 0.8566534868147326
Energy: 0.9234540561246866
Energy: 0.8909422024382017
Energy: 0.8550845483701891
Energy: 0.8173989351068168
Energy: 0.8539744982894456
Energy: 0.8548566550996857
Energy: 0.8573254390908197
Energy: 0.9530389652324739
Energy: 0.8589861933561478
Energy: 0.9430536210625374
Energy: 0.8546824022031423
Energy: 0.8673040420689886
Energy: 0.9042583317602663
Energy: 0.8597053729788195
Energy: 0.8560671981034229
Energy: 0.9183891018174132
Energy: 0.8951673413478666
Energy: 0.8567362871536562
Energy: 0.9034262661553027
Energy: 0.8943116760609708
Energy: 0.8548072995797568

minimum gb energy = 0.8047489440890145 eV
minimum distance =  2.39718124771059 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.567891127671369
Energy: 0.9801229685728214
Energy: 0.9648883144040035
Energy: 0.8694358701008035
Energy: 1.0405115434032095
Energy: 0.7678845551563521
Energy: 0.7342829867931192
Energy: 0.8034036529741406
Energy: 0.7961336896748773
Energy: 0.7478759240345013
Energy: 0.8069082845702557
Energy: 0.745607543767986
Energy: 1.0510193312133145
Energy: 0.8011717203794584
Energy: 0.7977661693354746
Energy: 0.8024263736831293
Energy: 0.8019977063987839
Energy: 0.747289078551371
Energy: 1.0442557605490794
Energy: 0.7869274719192834
Energy: 0.7864737485968032
Energy: 0.7633456011058185
Energy: 0.8397944332524866
Energy: 0.7842787298589994
Energy: 0.9470959412020546
Energy: 0.7982259849721364
Energy: 0.7528321137736188
Energy: 0.8765698043151545
Energy: 0.7983922029335918
Energy: 0.7687673542698208
Energy: 0.8715658583285493
Energy: 0.7504332600205695
Energy: 0.7527762436265766
Energy: 0.8714822365656245
Energy: 0.7545290450773514
Energy: 0.8433157668960454
Energy: 0.8693646942191168
Energy: 0.7500185196499527
Energy: 0.7503414991978825
Energy: 0.8699317103043933
Energy: 0.7918621677431137
Energy: 0.8421133068542995
Energy: 0.8891882898524788
Energy: 0.7627178247887115
Energy: 0.9300803364555801
Energy: 0.8899443867760024
Energy: 0.7603060418806211
Energy: 0.8880083790583219
Energy: 0.7939726265803392
Energy: 0.8434600909276112
Energy: 0.7715613743424834
Energy: 0.8691801373750574
Energy: 0.8436378912571036
Energy: 0.7924098803463875
Energy: 1.22696721482523
Energy: 0.8677969051033532
Energy: 0.8677257821801596
Energy: 0.7550705780163923
Energy: 0.9034045029377901
Energy: 0.8393207105362664
Energy: 0.9847624756426809
Energy: 0.8750189098273989
Energy: 0.8755128818317841
Energy: 0.8061541940572159
Energy: 0.8748008911105053
Energy: 0.7741329829921634
Energy: 0.8536198538559729
Energy: 0.8763616566962853
Energy: 0.8775493191100378
Energy: 0.7667849987247746
Energy: 0.8770080320798016
Energy: 0.7398416801108537
Energy: 1.3907496328365285
Energy: 0.9562551424401663
Energy: 0.862997180834474
Energy: 0.7815414259472752
Energy: 0.8763243391584573
Energy: 0.8165961889950956
Energy: 0.9556087396770353
Energy: 0.7984178258972586
Energy: 0.7520159420813728
Energy: 0.7663352626805681
Energy: 0.8752914564293226
Energy: 0.7505098415670661
Energy: 0.8011589820720356
Energy: 0.7597220386212905
Energy: 0.756498724127945
Energy: 0.8012758213168221
Energy: 0.7619047671891048
Energy: 0.7421189672105544
Energy: 0.8011279248582961
Energy: 0.7550428922927003
Energy: 0.7440196839573251
Energy: 0.8009158555513869
Energy: 0.8015979701394306
Energy: 0.7477120835644265
Energy: 0.8046313280110633
Energy: 0.764041631394839
Energy: 0.7625557353593777
Energy: 0.8075066364061907
Energy: 0.7620840316102806
Energy: 0.8355454064995801
Energy: 0.8544234161773768
Energy: 0.7729726846975611
Energy: 0.73027866676568
Energy: 0.8082489385227417
Energy: 0.7794855777048652
Energy: 0.8343989511363684
Energy: 0.7978457196274003
Energy: 0.7494343697576042
Energy: 0.7470139735844687
Energy: 0.7820923259305466
Energy: 0.7617826699490668
Energy: 0.7664849903112477
Energy: 0.7956637256297452
Energy: 0.7525804130169061
Energy: 0.7476827497779794
Energy: 0.7511393509460895
Energy: 0.7515784178531076
Energy: 0.7477778377640888
Energy: 0.797690424729222
Energy: 0.751307742228958
Energy: 0.7614129577786605
Energy: 0.8019243342291112
Energy: 0.7551165962410583
Energy: 0.7509809036216624
Energy: 0.8541334986306444
Energy: 0.8026768923086185
Energy: 0.8706385564955833
Energy: 0.7961304908521348
Energy: 0.8085094150429041
Energy: 0.7668992293460865
Energy: 0.8569196726096918
Energy: 0.8023936788676701
Energy: 0.7983229760229159
Energy: 0.7956504602406262
Energy: 0.8073391166680597
Energy: 0.7745904497743994
Energy: 0.7973996565522165
Energy: 0.7969580263895045
Energy: 0.7479589647812874
Energy: 0.8060046199440024
Energy: 0.8011538172679494
Energy: 0.7558101230757512
Energy: 1.0353988280763529
Energy: 0.8019945070924235
Energy: 0.7820262970495061
Energy: 0.8217863249897368
Energy: 0.8121591636404745
Energy: 0.7842175977114787
Energy: 0.7993429475158711
Energy: 0.7663633069356811
Energy: 0.7508198851250573
Energy: 0.8731973570574695
Energy: 0.7665445707143016
Energy: 0.7504587857820104
Energy: 0.7562565637497825
Energy: 0.7718748612114078
Energy: 0.7784605065600396
Energy: 0.7561532198483271
Energy: 0.8392122894962465
Energy: 0.7321696216890091
Energy: 0.8751333646821408
Energy: 0.7394072356583278
Energy: 0.7395862811089355
Energy: 0.8773136334350038
Energy: 0.7885038056402986
Energy: 0.8362151108811667
Energy: 0.8897168333069654
Energy: 0.843036158445039
Energy: 0.7731911777959344
Energy: 0.8899491231980323
Energy: 0.8424474830353167
Energy: 0.8754462429493547
Energy: 0.791290652508018
Energy: 0.7627376835907811
Energy: 0.8975618377287142
Energy: 0.8927615285170787
Energy: 0.7603703260678801
Energy: 0.8840329037573916
Energy: 0.7338740640582228
Energy: 0.8682589199389025
Energy: 0.7930182821123222
Energy: 0.8083865191885146
Energy: 0.873384448175628
Energy: 0.7720841699802421
Energy: 1.2295666860756873
Energy: 0.8886112054234985
Energy: 0.8883270932299266
Energy: 0.7559425878774858
Energy: 0.8902852847267854
Energy: 0.8671782732784477
Energy: 0.9561504096795654
Energy: 0.8772432642674387
Energy: 0.8103677685992928
Energy: 0.8314214939664416
Energy: 0.8548848843088506
Energy: 0.7504991053046424
Energy: 1.0415646039469215
Energy: 0.8767213075638052
Energy: 0.8773812417499468
Energy: 0.7816051765945554
Energy: 0.8778673420819865
Energy: 0.8790241604272563
Energy: 0.7978519714700081
Energy: 0.8771321043541587
Energy: 0.837149312354989
Energy: 0.8022061864865411
Energy: 0.8761919366500617
Energy: 0.7660129862512728
Energy: 0.799895975622842
Energy: 0.7621469735863337
Energy: 0.8783884040923524
Energy: 0.801997207172456
Energy: 0.7627386592033991
Energy: 0.8010807046230797
Energy: 0.8101579555821173
Energy: 0.8346934046100761
Energy: 0.7480575959683314
Energy: 0.8104328217110138
Energy: 0.8325894683921145
Energy: 0.7976267190471138
Energy: 0.8051602311045141
Energy: 0.7481261268003411
Energy: 0.7485401506189465
Energy: 0.807841359722471
Energy: 0.7716250685270158
Energy: 0.8329646746302797
Energy: 0.9415769534675361
Energy: 0.7784211884399189
Energy: 0.851504993182403
Energy: 0.9180165282491374
Energy: 0.8232286819740113
Energy: 0.8891365738391072
Energy: 0.7989807114757693
Energy: 0.7504476048958238
Energy: 0.7477759273739983
Energy: 0.8079421521872976
Energy: 0.7477921676350754
Energy: 0.7458173668415204
Energy: 0.7926119718643055
Energy: 0.7514901058824682
Energy: 0.7475839605845874
Energy: 0.7484554492886925
Energy: 0.7577778911829995
Energy: 0.7469498247863869
Energy: 0.7986416534632601
Energy: 0.753034890766091
Energy: 0.7473094085835023
Energy: 0.7554033063373157
Energy: 0.7521395906217302
Energy: 0.7514519396550422
Energy: 0.8570485908364642
Energy: 0.8029207920602479
Energy: 0.8308205597960882
Energy: 0.7957617932657277
Energy: 0.8069714306696061
Energy: 0.7748355247580715

minimum gb energy = 0.73027866676568 eV
minimum distance =  2.4013002880065 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.748915307837123
Energy: 0.701598242173914
Energy: 0.42693574907228116
Energy: 0.3977497078836205
Energy: 0.6286299302108984
Energy: 0.740918302930158
Energy: 0.7514985085699256
Energy: 0.6269306619138072
Energy: 0.6282499598035676
Energy: 0.6444358521977445
Energy: 0.6267800122541094
Energy: 0.6330682394432794
Energy: 1.0718430228582807
Energy: 0.630249039516626
Energy: 0.6116944356186503
Energy: 0.6123498663056085
Energy: 0.6279217576414186
Energy: 1.03853723845307
Energy: 0.8461803673865008
Energy: 0.6360966094933229
Energy: 0.658113145648218
Energy: 0.7825595443699276
Energy: 0.6183026832555762
Energy: 0.6273630207788065
Energy: 0.7912284170319198
Energy: 0.521559817596645
Energy: 0.525027092790885
Energy: 0.790447127847745
Energy: 0.522314288788086
Energy: 0.8151975878818726
Energy: 0.8093807831269223
Energy: 0.5223030059181745
Energy: 0.5218008975739101
Energy: 0.7865877973436215
Energy: 0.51358043666097
Energy: 0.5373047852357767
Energy: 0.8084541952668697
Energy: 0.8157690457870704
Energy: 0.6294426802253219
Energy: 0.782962701016011
Energy: 0.6033226644254885
Energy: 0.8185453530928253
Energy: 1.072842320806968
Energy: 1.0164616844634842
Energy: 0.9661859182746848
Energy: 1.079466330740041
Energy: 1.0419371019329395
Energy: 1.0099201845888668
Energy: 0.8176782472654632
Energy: 0.8551029195085789
Energy: 0.8396385255796286
Energy: 0.8090333944518356
Energy: 0.8090849414797815
Energy: 0.8473149491544142
Energy: 0.630441073708771
Energy: 0.8542257656257205
Energy: 0.4282970730591186
Energy: 0.3963762886928332
Energy: 0.8177097707653991
Energy: 0.6218754515885108
Energy: 0.6305650996754883
Energy: 0.8151331802050831
Energy: 0.8386500128138255
Energy: 0.3965137008527531
Energy: 0.8077321796337648
Energy: 0.5948901556134022
Energy: 0.8373165479960266
Energy: 0.8169978202751451
Energy: 0.8170534680781635
Energy: 0.8167480462128136
Energy: 0.809500057971746
Energy: 1.0308483950891494
Energy: 0.8255308984411424
Energy: 1.0353557107885096
Energy: 0.8474730438678058
Energy: 0.6530326349612732
Energy: 1.0887283135906767
Energy: 1.0458597311166786
Energy: 0.8236692997892116
Energy: 0.777402149027525
Energy: 0.801391149283206
Energy: 0.8411329124312666
Energy: 0.6283497231371198
Energy: 0.7715766505663643
Energy: 0.7927011304732229
Energy: 0.5204698902352396
Energy: 0.5223002319594896
Energy: 0.7937784850354628
Energy: 0.5141730811887212
Energy: 0.5403225790863777
Energy: 0.7853302486674703
Energy: 0.7889254945224874
Energy: 0.6275043481692982
Energy: 0.7827462218493935
Energy: 0.5168123001120616
Energy: 0.7861033768648191
Energy: 1.0321260512155417
Energy: 0.8523274693013029
Energy: 0.9549769516178455
Energy: 0.8338646035526214
Energy: 1.0470154764868165
Energy: 0.8000017194296167
Energy: 0.8461996571121891
Energy: 0.6357764485187917
Energy: 0.6395290577283426
Energy: 0.6139547779140486
Energy: 0.6494231359539786
Energy: 1.0076211603160734
Energy: 0.7511037782944541
Energy: 0.6279100514538225
Energy: 0.6277844046820157
Energy: 0.39656786404139394
Energy: 0.6271638776127266
Energy: 0.6436176441469605

minimum gb energy = 0.3963762886928332 eV
minimum distance =  2.2730918900253 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.2316652116650881
Energy: 0.9149181490271742
Energy: 0.9045283896217747
Energy: 1.1228348657516936
Energy: 0.8796485801601599
Energy: 1.329875184515556
Energy: 0.6420377034543654
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Energy: 0.6311713672638539
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Energy: 0.6438021944283511
Energy: 0.648075491810479
Energy: 0.6616621839611865
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Energy: 0.654176503893715
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Energy: 0.6440308816365746
Energy: 0.6408412897886493
Energy: 0.676076270100189
Energy: 0.6312348055393362
Energy: 0.7103812384545926
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Energy: 0.7069196912964756
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Energy: 0.6705329726740077
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Energy: 0.707819770921095
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Energy: 1.1330304828726592
Energy: 0.8481584960241291
Energy: 0.9517939946251637
Energy: 1.1346399641676812
Energy: 1.0083800939842764
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Energy: 1.1117641982345337
Energy: 0.7507592859454816
Energy: 0.7444602133793798
Energy: 0.6471708794308353
Energy: 0.7187856613088849
Energy: 0.7427225877278496
Energy: 0.9290763930308136
Energy: 0.8102201097397389
Energy: 0.8599760299551156
Energy: 0.8947095382656886
Energy: 0.9474735812486491
Energy: 0.7430260968232602
Energy: 1.1350832437871956
Energy: 0.7563327417126983
Energy: 0.7448948993703155
Energy: 0.6649365323657362
Energy: 0.6588656950280691
Energy: 0.745772081856456
Energy: 0.9174274574213983
Energy: 0.7163802480926349
Energy: 0.6980913974975924
Energy: 0.6436700076404895
Energy: 0.7095990903350853
Energy: 0.6923168628594997
Energy: 0.7909276337880177
Energy: 0.898661260770873
Energy: 0.8484422718282554
Energy: 0.7833809712671864
Energy: 0.9890171440787998
Energy: 0.7323071448847295
Energy: 1.1114254853164338
Energy: 0.7107620543741515
Energy: 0.709552499262737
Energy: 0.6554227210226481
Energy: 0.7466619820943878
Energy: 0.6952365723651288
Energy: 0.8620466666285393
Energy: 0.940474798101624
Energy: 0.9319801562675384
Energy: 0.8487405690248794
Energy: 1.0777153199208784
Energy: 0.7724323000443823
Energy: 0.6286349591958278
Energy: 0.7102777413485243
Energy: 0.7077194146446871
Energy: 0.6400553468350858
Energy: 0.6977784324832782
Energy: 0.6961453380040036
Energy: 0.7313989525956343
Energy: 0.6470547375437927
Energy: 0.6568412693671724
Energy: 0.7322460149749677
Energy: 0.6453453197699135
Energy: 0.7327557769991112
Energy: 0.7344374154254454
Energy: 0.6479187947417554
Energy: 0.6614313796626822
Energy: 0.735370665744791
Energy: 0.6444382306320556
Energy: 0.6542236740949613
Energy: 1.0867447704725204
Energy: 0.699110409108806
Energy: 0.7123169624270859
Energy: 0.7693308761368058
Energy: 0.6484743460516907
Energy: 0.7387447371257008

minimum gb energy = 0.6218285162805647 eV
minimum distance =  2.39479082293396 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.1928918650325826
Energy: 1.0745554262187336
Energy: 1.3971558965794624
Energy: 1.0347305079031062
Energy: 1.0749702704870023
Energy: 1.030266912594839
Energy: 0.7075676000707165
Energy: 0.7135569503369928
Energy: 0.7094368297896428
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Energy: 0.6925391240635199
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Energy: 0.7055423798370865
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Energy: 0.9954128908384031
Energy: 0.709195844402207
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Energy: 0.868839336893879
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Energy: 0.7093150684008335
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Energy: 0.8551248444215683
Energy: 0.8563477530924725
Energy: 0.7366704041449328
Energy: 0.8557523943598373
Energy: 0.6777979055840201
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Energy: 0.7093000715225105
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Energy: 0.7165753374503083
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Energy: 0.8540908366312983
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Energy: 0.6759999004823317
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Energy: 0.6700442386022826
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Energy: 0.6924340062139728
Energy: 0.7080823908949482
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Energy: 0.7104807579034551
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Energy: 0.8551358003463196
Energy: 0.8557718324885828
Energy: 1.0399064731059562
Energy: 0.8510949628429642
Energy: 0.8534915893598756
Energy: 0.9899999036351821
Energy: 0.7078410767420885
Energy: 0.709376578108297
Energy: 0.6920818809727751
Energy: 0.715256418779931
Energy: 0.7088363490071686
Energy: 0.7076862002571718
Energy: 0.8507302993375505
Energy: 0.8493016290596573
Energy: 0.7363384816637664
Energy: 0.863781560441573
Energy: 0.6776931777645243
Energy: 0.9975860547312164
Energy: 0.7112738876683332
Energy: 0.70922913651362
Energy: 0.6983832271471563
Energy: 0.7088400016029324
Energy: 0.7206928546107741
Energy: 0.9324704221382891
Energy: 0.7125306504780643
Energy: 0.7163532344488556
Energy: 0.9017011423015149
Energy: 0.6940328455012268
Energy: 0.7180066981717512
Energy: 0.9323910068019199
Energy: 0.8557867966557341
Energy: 0.8554661548666546
Energy: 0.8472083293730777
Energy: 0.8570117705493687
Energy: 0.8561217152525579
Energy: 0.9960878190018597
Energy: 0.6803937878457392
Energy: 0.7158763186714785
Energy: 0.6954021304595692
Energy: 0.6750158847175066
Energy: 0.7192397855697296
Energy: 0.8629138034173265
Energy: 1.013439816321499
Energy: 0.8764831564691412
Energy: 1.0398784183285517
Energy: 0.8750794993510699
Energy: 1.0268355579053938
Energy: 0.6900698128834442
Energy: 0.7191089365578545
Energy: 0.7135508923361764
Energy: 0.710505023633113
Energy: 0.811398325673953
Energy: 0.7134143165970678
Energy: 0.8546452931651375
Energy: 0.7164768448305096
Energy: 0.7211945244411974
Energy: 0.8546697073469154
Energy: 0.7126419487714274
Energy: 0.8559247099748168
Energy: 0.6917226022345816
Energy: 0.7165888062515104
Energy: 0.7154358634375951
Energy: 0.6991977537005745
Energy: 0.7025437498766092
Energy: 0.7156601376030424
Energy: 1.146600993691721
Energy: 0.6951699234823641
Energy: 0.6756122205573367
Energy: 1.020372073692862
Energy: 0.696041209835591
Energy: 0.6781185468246302

minimum gb energy = 0.6700442386022826 eV
minimum distance =  2.44691451738451 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.9581711017678659
Energy: 0.8349867113329157
Energy: 0.8369973310778157
Energy: 0.751961063560744
Energy: 0.8214063077634322
Energy: 0.8382271139662407
Energy: 0.7827092051448852
Energy: 0.7616082008512464
Energy: 0.7749097860539779
Energy: 0.7754045494780298
Energy: 0.7591458760546729
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Energy: 0.7624066972262648
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Energy: 0.7673113616644209
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Energy: 0.7652095558999172
Energy: 0.7604120063141496
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Energy: 0.7657374210875327
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Energy: 0.7485227316178334
Energy: 0.7581324052972662
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Energy: 1.009148755501891
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Energy: 0.7673239239306628
Energy: 0.793016256125072
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Energy: 0.7709921240256317
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Energy: 0.7378215229954596
Energy: 0.7587081365638866
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Energy: 0.7590150060191695
Energy: 0.7375615743467618
Energy: 1.4206619003073122
Energy: 0.8112106071540875
Energy: 0.7275405450739828
Energy: 0.7418856186688925
Energy: 0.7931313261785757
Energy: 0.7271757369807237

minimum gb energy = 0.7271757369807237 eV
minimum distance =  2.44940381846383 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.1072963801995257
Energy: 0.8163674831482228
Energy: 0.8159413925769697
Energy: 0.8171281795304317
Energy: 0.8622000357398714
Energy: 0.8160176378503049
Energy: 1.0141977814948913
Energy: 0.8713479900471456
Energy: 0.8193160687696537
Energy: 0.8209660762725569
Energy: 0.8722872385232932
Energy: 0.8184909410029192
Energy: 0.8729366326335659
Energy: 0.8090063897433322
Energy: 0.8471143041184462
Energy: 0.8402826754462118
Energy: 0.80885716175435
Energy: 0.8469066980314517
Energy: 0.8686803610160545
Energy: 0.8192702255267702
Energy: 0.8195689261150211
Energy: 0.8736576013109785
Energy: 0.8411919599246052
Energy: 0.8192609596304313
Energy: 0.8448866577578842
Energy: 0.8209063866371378
Energy: 0.8219541506835665
Energy: 0.8467435407782737
Energy: 0.8230997913161624
Energy: 0.8438205031520051
Energy: 0.8441309471367122
Energy: 0.8246872514010128
Energy: 0.8394263164108045
Energy: 0.8446184684692558
Energy: 0.8239877695704193
Energy: 0.8485634546179391
Energy: 1.0010191859665785
Energy: 0.8211189850572058
Energy: 0.818986851401641
Energy: 0.8522503906346472
Energy: 0.8237547221215802
Energy: 0.819164963421031

minimum gb energy = 0.80885716175435 eV
minimum distance =  2.43070229740142 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.8964439953119124
Energy: 1.0906372567151597
Energy: 1.0040822372351563
Energy: 1.0267576346933487
Energy: 1.0159527139179225
Energy: 1.0059733307784129
Energy: 0.947313720250977
Energy: 0.9286201670703006
Energy: 0.9429695099129751
Energy: 0.9900798807676704
Energy: 0.9228087727735977
Energy: 0.9405558987465795
Energy: 1.0129408436284184
Energy: 0.9629129046963159
Energy: 0.9637590826256643
Energy: 1.0057084885111465
Energy: 0.9628630567123707
Energy: 0.989296083427825
Energy: 0.9346335686695306
Energy: 0.9396113954386444
Energy: 0.937426311737067
Energy: 0.9355373402992074
Energy: 0.9618788059851369
Energy: 0.9375215903851706
Energy: 0.9278521488672148
Energy: 0.9483773954797432
Energy: 0.9461770858819859
Energy: 0.9275549256899465
Energy: 0.9456484990946635
Energy: 0.9474334033278111
Energy: 0.9944632132799525
Energy: 0.9484732888373031
Energy: 0.9493898956695279
Energy: 0.9639009271381
Energy: 0.9450388096096518
Energy: 0.9503704555379899
Energy: 0.9235225230717232
Energy: 0.9538318121325782
Energy: 0.9250632856535782
Energy: 0.8971645486562122
Energy: 0.959455511727017
Energy: 0.9588163787344302
Energy: 0.9939416989460442
Energy: 0.9651588569972581
Energy: 1.0163757168339935
Energy: 0.99287488673832
Energy: 1.0902725840917882
Energy: 1.0114344594202873
Energy: 0.9331311094505325
Energy: 0.9466509531359171
Energy: 0.9537770011550671
Energy: 0.960600463290441
Energy: 0.9236785314196028
Energy: 0.9929167560781657
Energy: 1.109423862790124
Energy: 1.005588434286879
Energy: 1.0062692575328394
Energy: 1.0565654819042587
Energy: 0.9821005300593197
Energy: 0.9457490515838357
Energy: 0.9321874843655656
Energy: 0.9557737954776887
Energy: 0.9745345136580981
Energy: 0.9548867596748923
Energy: 0.9140661855417543
Energy: 0.9512826010495741
Energy: 0.9485908199132228
Energy: 0.9449137496138035
Energy: 0.9483245140821254
Energy: 0.9368104368054881
Energy: 0.9524259696943831
Energy: 0.9497156111958965
Energy: 0.9080035027659882
Energy: 0.9487473336330863
Energy: 0.9486867820615819
Energy: 0.9287747014433625
Energy: 0.9422259360276602
Energy: 0.9499684959051191
Energy: 0.9573463123935274
Energy: 0.934141060525955
Energy: 0.9410943799743117
Energy: 0.9375139675159117
Energy: 0.9300928084809866
Energy: 0.9405491597317935
Energy: 0.9481717429196446
Energy: 0.9946419702042373
Energy: 0.9846180203546592
Energy: 0.9475085588707279
Energy: 0.9937859631277959
Energy: 0.9966125493691395
Energy: 1.0184530720734166
Energy: 0.9475590907917806
Energy: 0.9494813027372889
Energy: 0.9186105328405451
Energy: 0.97585083322212
Energy: 0.9453175085883875
Energy: 1.083667902644777
Energy: 0.9838683705109051
Energy: 0.9932551092655195
Energy: 1.0844606251454865
Energy: 0.9930819345473298
Energy: 0.9774531894158406
Energy: 0.912880458196943
Energy: 0.9450634771508474
Energy: 0.9678980799425501
Energy: 0.9133185476622833
Energy: 0.9375537866348689
Energy: 0.9257226597421803
Energy: 1.08407043532761
Energy: 0.9885897476035486
Energy: 0.9876404246456735
Energy: 0.9865298630308256
Energy: 0.9958899604257431
Energy: 0.9646907562776884
Energy: 0.9864090968000777
Energy: 0.9893605502938345
Energy: 0.9444919701772623
Energy: 0.9819678624201763
Energy: 0.9962190656192298
Energy: 0.9634816147706309
Energy: 0.9124340762765656
Energy: 0.923703349715241
Energy: 0.9268554930754175
Energy: 0.9135635937339935
Energy: 0.9129768618614561
Energy: 0.9255387699242696
Energy: 0.9059578757517459
Energy: 0.9330968219696595
Energy: 0.9386303415411197
Energy: 0.932444311271703
Energy: 0.9324676330046197
Energy: 0.9372630244424549
Energy: 0.9717843274552547
Energy: 0.9281127073108069
Energy: 0.9205916568928317
Energy: 0.9690316235525757
Energy: 0.9082634615872018
Energy: 0.9164796793386535
Energy: 1.0102528389406917
Energy: 0.994399118896217
Energy: 0.9985467234381448
Energy: 1.0103603620774817
Energy: 0.9875488616773221
Energy: 0.9869385154581806
Energy: 0.9942598198537222
Energy: 0.9219827115303957
Energy: 0.9422559926950802
Energy: 0.9795946188926857
Energy: 0.9079434303195225
Energy: 0.9513479595824158
Energy: 1.0024795516608507
Energy: 0.9303972384104943
Energy: 0.9315664046212236
Energy: 0.9739390086206255
Energy: 1.0020365340389352
Energy: 0.9603606610965117
Energy: 0.9032829916690941
Energy: 0.9315193639908982
Energy: 0.9259777031038463
Energy: 0.9511167984493275
Energy: 1.0034407687507916
Energy: 0.9678368213676147
Energy: 0.9945395341576142
Energy: 0.9362680192860293
Energy: 0.9366512438293486
Energy: 0.980147493456096
Energy: 0.9324787419923166
Energy: 0.9457555648867121
Energy: 0.9985584069192995
Energy: 0.963905271150572
Energy: 0.9648992372309382
Energy: 1.001372802546033
Energy: 0.9629615644779195
Energy: 0.9867498262539719
Energy: 0.9492900107986875
Energy: 0.961840270806146
Energy: 0.9490290499541362
Energy: 0.9253499396769098
Energy: 0.9428423493129544
Energy: 0.9325773308463795
Energy: 0.997516174678313
Energy: 0.96133177691281
Energy: 0.9557995092772369
Energy: 0.9657956405829088
Energy: 0.9646910434804656
Energy: 0.9661707594490393
Energy: 0.934308323512818
Energy: 0.9363011057244973
Energy: 0.9461420848767996
Energy: 0.893104778768237
Energy: 0.9345486873504777
Energy: 0.9496451442243008
Energy: 0.9986181729704768
Energy: 0.9801394925890236
Energy: 0.9540583388294678
Energy: 0.9707145336600181
Energy: 0.9881937731590453
Energy: 0.9864213489604409
Energy: 0.9025972016452694
Energy: 0.9451058802129806
Energy: 0.9461251930824877
Energy: 0.9542854224137124
Energy: 0.9507646235615671
Energy: 0.9463220181588552
Energy: 0.9385472392228896
Energy: 0.9625685320571115
Energy: 0.9751702142696057
Energy: 0.9386698124770014
Energy: 0.9432691846610934
Energy: 0.9514697296980178
Energy: 0.9884726265935129
Energy: 1.0051623359285649
Energy: 1.0068559765282066
Energy: 0.9887939864476895
Energy: 0.9805529737420308
Energy: 0.9455577961041293
Energy: 0.966506041359604
Energy: 0.9508702170305607
Energy: 0.9507825819610066
Energy: 0.9425835152894765
Energy: 0.9371165510897672
Energy: 0.9516548919489985
Energy: 1.073461846031509
Energy: 0.9665535857966914
Energy: 0.9592953309306298
Energy: 0.9283326731226065
Energy: 0.9449059012455479
Energy: 0.9535051081241793
Energy: 0.9587766428028854
Energy: 0.9224152986295456
Energy: 0.9229733637629208
Energy: 0.9263658132608777
Energy: 0.9189192874810481
Energy: 0.9471348333843107
Energy: 0.9482283829056145
Energy: 0.9959448278158066
Energy: 0.9964815096667635
Energy: 0.946726498268287
Energy: 0.9977276513701914
Energy: 0.9900268681115386
Energy: 1.054064099597729
Energy: 0.9913706389077476
Energy: 0.9393816244404701
Energy: 0.9644837539287633
Energy: 0.9813133589961653
Energy: 0.94288875446686
Energy: 0.8926241689631347
Energy: 0.9562540120123056
Energy: 0.9551201940150976
Energy: 0.9197941129279942
Energy: 0.9572156324583716
Energy: 0.9261384365982167
Energy: 0.9986167738820102
Energy: 0.9920773776835091
Energy: 0.9869604705789338
Energy: 1.0115214543292768
Energy: 0.9798408610832301
Energy: 0.9776976656975653
Energy: 0.9063979001843501
Energy: 0.941871284561918
Energy: 0.947593526621807
Energy: 0.8965118913653706
Energy: 0.9404348278361113
Energy: 0.9487474397757506
Energy: 1.061647745392711
Energy: 1.0053402427126343
Energy: 1.0241612177125639
Energy: 0.9793885822959657
Energy: 1.0128715864958677
Energy: 1.0232333609031992
Energy: 0.9063010393110077
Energy: 0.918167999452214
Energy: 0.9224408843435824
Energy: 0.8970376929959663
Energy: 0.949903609558104
Energy: 0.918764586433708
Energy: 0.9071332726887366
Energy: 0.938124700361877
Energy: 0.9373294651287
Energy: 0.933446347592679
Energy: 0.9293345183631228
Energy: 0.9363549875750269
Energy: 0.9108394648841428
Energy: 0.9276030021596469
Energy: 0.9260257448868401
Energy: 0.9121950730604562
Energy: 0.9208374434549467
Energy: 0.9248921681524186
Energy: 0.9502347013578101
Energy: 0.9714918851264323
Energy: 0.9465591380763295
Energy: 0.9508280993417154
Energy: 0.9612473491654744
Energy: 0.9481361862929345
Energy: 0.9995365506231364
Energy: 0.9719637299147752
Energy: 0.9721230735002772
Energy: 1.0031042852893586
Energy: 0.9707937379602246
Energy: 0.9893964558856431
Energy: 0.9449534600858769
Energy: 0.9262373825895274
Energy: 0.9275778269995151
Energy: 0.9659104335417805
Energy: 0.922441553522986
Energy: 0.918538830015571

minimum gb energy = 0.8926241689631347 eV
minimum distance =  2.37620444539346 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.659135348015732
Energy: 1.0244400652634298
Energy: 1.0240600492021033
Energy: 1.0594855382009565
Energy: 1.0793451044001143
Energy: 1.0243789402937535
Energy: 0.9218871475014043
Energy: 0.954231175861975
Energy: 0.957200859239064
Energy: 0.9539010778284517
Energy: 0.9590423126226827
Energy: 0.9097509587817548
Energy: 1.0044370107222058
Energy: 0.936287605791303
Energy: 0.9445644776832456
Energy: 1.026968161495916
Energy: 0.9339784730646983
Energy: 0.9817612117070577
Energy: 0.9417467330841875
Energy: 0.9320608776996954
Energy: 0.9553910436038949
Energy: 0.9336957232162392
Energy: 0.932235460252818
Energy: 0.9541035637960095
Energy: 0.9582893649965023
Energy: 0.918252063209332
Energy: 0.9110292628960298
Energy: 0.9583272937486308
Energy: 0.9181137788435163
Energy: 0.9106711657980896
Energy: 0.973386230609978
Energy: 0.9695936043232176
Energy: 0.9695331085227898
Energy: 0.9960630621513281
Energy: 0.9182802980623395
Energy: 0.969857435197268
Energy: 1.071495469213559
Energy: 0.9252477404445448
Energy: 0.9184986145097771
Energy: 0.9707685060028289
Energy: 0.9178448110146779
Energy: 0.9670330500269589
Energy: 0.9061260533389037
Energy: 1.0303571633276154
Energy: 1.0386192920836006
Energy: 0.9999520270799966
Energy: 1.0307060350351767
Energy: 1.0111343868881602
Energy: 1.0468969832550443
Energy: 0.9206065039087131
Energy: 0.9659541205161482
Energy: 1.01684295403456
Energy: 0.9294157511674299
Energy: 0.9644646403385019
Energy: 1.1446560731727136
Energy: 0.9129083145653872
Energy: 0.9152673925474952
Energy: 1.0929065592269567
Energy: 0.987365797650295
Energy: 0.9141513140064864
Energy: 1.0232215776914872
Energy: 0.9352158830571987
Energy: 0.9054849834352012
Energy: 1.0093363202943673
Energy: 0.908703196378814
Energy: 0.9054659036320275
Energy: 0.908933005091347
Energy: 0.9279965780692453
Energy: 0.9219143119939046
Energy: 0.9382390595729364
Energy: 0.9357113920489685
Energy: 0.9167968545116205
Energy: 0.9085199983387757
Energy: 0.9363528694373086
Energy: 0.9365195042435713
Energy: 0.9328524441931791
Energy: 0.987523705194923
Energy: 0.9387411362887971
Energy: 0.9295678395656651
Energy: 0.9683433613354534
Energy: 0.9178463942979043
Energy: 0.9127407877381031
Energy: 0.9463174673195551
Energy: 0.924469392576262
Energy: 1.0300533473858375
Energy: 1.0164284420426715
Energy: 1.0217429074237068
Energy: 0.9867183373183436
Energy: 1.0190373674893598
Energy: 0.9811242616612847
Energy: 0.9491910561110652
Energy: 0.9903272168590234
Energy: 0.9860429639142386
Energy: 0.9116962539735713
Energy: 0.9808926847950001
Energy: 0.9768621189984696
Energy: 1.0652071408136918
Energy: 1.0070503577047676
Energy: 1.006299583489914
Energy: 1.0770914817458843
Energy: 0.9704490252580528
Energy: 1.011188837518791
Energy: 0.9032843398217711
Energy: 0.9710999954172348
Energy: 0.9732982679350827
Energy: 0.9148023718528425
Energy: 0.9693170508053989
Energy: 0.9257382388726942
Energy: 0.9043625044533438
Energy: 1.0061036836422457
Energy: 0.9711297199242017
Energy: 0.910743665674841
Energy: 1.0341059321062172
Energy: 0.9293436500511797
Energy: 0.9052994150455624
Energy: 1.0264264519578337
Energy: 0.9771147383499664
Energy: 0.9289794365894902
Energy: 1.0264454415091915
Energy: 0.9258763192998334
Energy: 0.9040187359337539
Energy: 0.9225783559963375
Energy: 0.9238755184209423
Energy: 0.9335555763979422
Energy: 0.9152549180091372
Energy: 0.9228867771604992
Energy: 0.9112650671377056
Energy: 0.9547840358696416
Energy: 0.9508318407527785
Energy: 0.9461345331124423
Energy: 0.9528758196470724
Energy: 0.9615049487977704
Energy: 0.9974371276640075
Energy: 0.9393495170238636
Energy: 0.9362056079370557
Energy: 0.9597063957382347
Energy: 0.9454327999208898
Energy: 0.9244832152322537
Energy: 1.0086209590966058
Energy: 0.9567141941817149
Energy: 0.9864393857431484
Energy: 1.0176211769825956
Energy: 0.9135045677380318
Energy: 1.0173150285807018
Energy: 1.0281385505059062
Energy: 0.975231310807302
Energy: 0.9819144239036584
Energy: 0.9611514520190879
Energy: 0.9131874828733072
Energy: 0.974947139106846
Energy: 0.9576672823283744
Energy: 1.017818781311608
Energy: 0.964102043836647
Energy: 0.9576661209481335
Energy: 1.0265441248957274
Energy: 0.9605576700618199
Energy: 0.9063678922794237
Energy: 0.9281211015014157
Energy: 0.9292761638570758
Energy: 0.961253350249363
Energy: 0.9412505241204876
Energy: 0.9164182200669678
Energy: 1.0543243857452846
Energy: 0.9852018538793275
Energy: 0.9856033369043344
Energy: 1.0102031035053016
Energy: 0.9689584562018818
Energy: 0.9605986656471591
Energy: 1.1381105333504884
Energy: 0.8998468145991485
Energy: 0.9221877613780596
Energy: 1.135257429442863
Energy: 0.9119188676198849
Energy: 0.9153807254523694
Energy: 1.04252452633081
Energy: 0.9220280190401362
Energy: 0.9147670858986333
Energy: 1.0161475327381313
Energy: 0.9299213386710986
Energy: 0.9338948709810674
Energy: 0.9780500339773032
Energy: 0.9570912046810932
Energy: 0.9468322819892845
Energy: 0.9337108507706144
Energy: 0.9482293391292269
Energy: 0.9526125886938982
Energy: 0.9873396907630237
Energy: 0.8992958153860793
Energy: 0.9173522201511322
Energy: 0.9412594120094275
Energy: 0.8967454967944388
Energy: 0.9159112868878763
Energy: 0.9098904281700119
Energy: 0.9609029637671542
Energy: 0.916580373510021
Energy: 0.9128533652667183
Energy: 0.9117038301077095
Energy: 0.9479962580860157
Energy: 0.9104084329558481
Energy: 0.9675688410981448
Energy: 0.9608831879655051
Energy: 0.9817920182107516
Energy: 0.9667737021272826
Energy: 0.9608761106719147
Energy: 0.9586781103247043
Energy: 1.000921335374629
Energy: 0.9563126095141297
Energy: 0.9588550051817667
Energy: 0.9597685115387093
Energy: 0.9583313893739257
Energy: 1.087057265009534
Energy: 1.0012736746648614
Energy: 1.0014681713975668
Energy: 1.1052268003229988
Energy: 0.9584212429420091
Energy: 1.04393441538067
Energy: 0.9599181379421048
Energy: 0.9559575997001348
Energy: 0.9570302016916082
Energy: 0.9550806894098357
Energy: 0.9580767091378396
Energy: 0.9821584112648151
Energy: 1.0365331403088236
Energy: 1.1231166223730709
Energy: 1.0257179561741563
Energy: 0.9813982665088495
Energy: 1.1114053453052875
Energy: 1.0153371790203773

minimum gb energy = 0.8967454967944388 eV
minimum distance =  2.32747165082966 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.8766758711896908
Energy: 0.9894104750786491
Energy: 1.0244145363741188
Energy: 1.0669419516114957
Energy: 1.0263782704157527
Energy: 1.0672520389862132
Energy: 1.110940017069438
Energy: 0.9087497655484854
Energy: 0.9087108217005087
Energy: 0.9488603505757992
Energy: 0.9035200735249815
Energy: 0.9238714237874358
Energy: 0.9474150294889895
Energy: 0.9379425718807718
Energy: 0.9331460563932042
Energy: 1.0680896063599432
Energy: 0.9310812862588819
Energy: 0.9397872728220427
Energy: 0.93951043720676
Energy: 0.9311829341994885
Energy: 0.9394320752680323
Energy: 0.9387505522477331
Energy: 0.9311974141176915
Energy: 0.9392399174877856
Energy: 0.8939621122894615
Energy: 0.908032383855572
Energy: 0.903642578523377
Energy: 0.8940994123222455
Energy: 0.9002316328425397
Energy: 0.9033996779824602
Energy: 0.8933777552838109
Energy: 0.9023047922097716
Energy: 0.9005060874929103
Energy: 0.9020686458993602
Energy: 0.9021023039690513
Energy: 0.9042104058498613
Energy: 0.892624399457377
Energy: 0.9465812393098759
Energy: 0.9468444640486041
Energy: 0.88870290438324
Energy: 0.9612538222274498
Energy: 0.9391298018085273
Energy: 1.018141653370519
Energy: 0.9669670183071947
Energy: 1.023090907810956
Energy: 0.9124065232372416
Energy: 0.967066244637702
Energy: 0.9414600271651931
Energy: 0.8895353326559423
Energy: 0.9645837372964143
Energy: 0.9644449451502408
Energy: 0.9060049431334262
Energy: 0.962976908285553
Energy: 0.9477919826597767
Energy: 1.1366601629139468
Energy: 0.9776485023395075
Energy: 0.9709504803186962
Energy: 0.9824506388108861
Energy: 0.9324977628020789
Energy: 0.9677887769311457
Energy: 0.8954126267754462
Energy: 1.0040673996087124
Energy: 0.9195896696992883
Energy: 0.909391930342859
Energy: 0.9563112704610279
Energy: 0.9112576576634714
Energy: 1.0231012378609776
Energy: 0.9480103278385829
Energy: 0.9483539766679803
Energy: 0.8878473401582776
Energy: 0.9486063890227483
Energy: 0.9482432165110402
Energy: 1.0233631513426962
Energy: 0.9398797902945988
Energy: 0.9430684175781173
Energy: 0.9299219482538084
Energy: 0.935497942720245
Energy: 0.9261149790773628
Energy: 0.8954622443721533
Energy: 0.9062265461746934
Energy: 0.9034149597843032
Energy: 0.9092758181940748
Energy: 0.9069961264616432
Energy: 0.8918221509318592
Energy: 0.8934775647511026
Energy: 0.9072448338291933
Energy: 0.9173939718456058
Energy: 0.9251039711207938
Energy: 0.9003185755575096
Energy: 0.9293558607461856
Energy: 0.9283678896495055
Energy: 0.9040135366335328
Energy: 0.8987961791529194
Energy: 0.9281679667420925
Energy: 0.9207352093298611
Energy: 0.8990227541165198
Energy: 0.9200241022198212
Energy: 0.9163097595718932
Energy: 0.9162860999463076
Energy: 0.9133202780527223
Energy: 0.9189376253056681
Energy: 0.9313513287989428
Energy: 0.9201127119547918
Energy: 0.9146391568012807
Energy: 0.9145785334314861
Energy: 0.9405346121744373
Energy: 0.968485575632404
Energy: 0.9146301410202534
Energy: 0.9519734604885278
Energy: 0.914660101465985
Energy: 0.9148744698356244
Energy: 0.9447350584745304
Energy: 0.947631437301892
Energy: 0.936686039244533
Energy: 0.952160311307306
Energy: 0.9149146422810011
Energy: 0.9147690590748445
Energy: 0.9356865188325081
Energy: 0.9475501666279238
Energy: 0.9363230768177054
Energy: 0.9209839496974197
Energy: 0.9220284207338381
Energy: 0.9592624653372122
Energy: 0.94130907731592
Energy: 0.9151173487823056
Energy: 0.9144797064653734
Energy: 1.0003548197639
Energy: 1.0075100520379356
Energy: 1.0430221377807107
Energy: 1.0187186062038844
Energy: 0.9682289656525646
Energy: 1.0779669910260476
Energy: 0.9596508670091413
Energy: 0.9219811465739017
Energy: 0.9224274142171542
Energy: 0.9268524013878228
Energy: 0.914548683091775
Energy: 0.9350071187950959
Energy: 1.0123151993047348
Energy: 0.9245081488533167
Energy: 0.9189801894321252
Energy: 0.9174031875896278
Energy: 1.0050580751079057
Energy: 0.9145014806794658
Energy: 0.9575742995921072
Energy: 0.9184138559914079
Energy: 0.9141842238821255
Energy: 0.9555574692045942
Energy: 0.9184014321502394
Energy: 0.9228659585536507
Energy: 0.9622164873214105
Energy: 0.9108248514942285
Energy: 0.9029897577026137
Energy: 0.9088297593353151
Energy: 0.8889000882764779
Energy: 0.9029980978764443
Energy: 0.9623620910929959
Energy: 0.911433114427264
Energy: 0.9111290557762648
Energy: 0.9138741981192858
Energy: 0.9331910097854155
Energy: 0.9053397636435835
Energy: 0.9848535456801052
Energy: 0.9072990738794083
Energy: 0.975525066588689
Energy: 0.9485601236977343
Energy: 0.9010051586117086
Energy: 0.9396562345603888
Energy: 0.9405742714761116
Energy: 0.9640007904059772
Energy: 0.9656318684958279
Energy: 1.0593723500093193
Energy: 0.9614711969516053
Energy: 0.9875501973082454
Energy: 0.9637020657821685
Energy: 0.9087640431411852
Energy: 0.9277882650098929
Energy: 0.9646540057276121
Energy: 0.9027416917118609
Energy: 0.9399023105711168
Energy: 0.8809767338709253
Energy: 0.9746917986452086
Energy: 0.9299388947435857
Energy: 0.9406013496881193
Energy: 0.9809829646005624
Energy: 0.9312622238700413

minimum gb energy = 0.8766758711896908 eV
minimum distance =  2.40203525487218 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.0925709984415852
Energy: 0.9330930991611035
Energy: 1.0293447426723688
Energy: 0.9150435709886724
Energy: 0.9463748808971185
Energy: 1.0192229794772192
Energy: 0.8411256204820171
Energy: 0.9409390678103696
Energy: 0.9080601326050819
Energy: 0.961914886166093
Energy: 0.9599596591275718
Energy: 0.8768013935764016
Energy: 1.075538588066902
Energy: 0.8689838981016468
Energy: 0.8322096813216807
Energy: 0.9792640231682262
Energy: 0.8692734812448106
Energy: 0.9113551979156042
Energy: 0.8844895466695245
Energy: 0.8686415727799719
Energy: 0.868920044467748
Energy: 0.8851890652306007
Energy: 0.8704572292129232
Energy: 0.9016470643061786
Energy: 0.9063591776231491
Energy: 0.8835886707997828
Energy: 0.8746769416996946
Energy: 0.906033828103562
Energy: 0.8744370329463055
Energy: 0.8750794525538852
Energy: 0.9904968595822352
Energy: 0.8952745015059831
Energy: 0.8949708841207042
Energy: 0.8769692088157952
Energy: 0.8726930484482802
Energy: 0.8751492010449465
Energy: 0.9494680562233233
Energy: 0.9208570143059843
Energy: 0.9214003217886699
Energy: 0.8723616596181423
Energy: 0.9211426429826481
Energy: 0.8848242232177463
Energy: 0.9109848744379411
Energy: 0.9604195304128273
Energy: 0.9676746199647468
Energy: 0.9155427326074917
Energy: 0.9607088721957534
Energy: 0.8823693630492148
Energy: 0.8922844291417587
Energy: 0.9413871578007971
Energy: 0.9405644106432287
Energy: 0.8925460781805751
Energy: 0.9406993261269341
Energy: 0.8774227494945238
Energy: 0.9214587346026449
Energy: 0.956318628206244
Energy: 0.9591055908724488
Energy: 0.9248856765017752
Energy: 0.9588955824917991
Energy: 0.959204703812854
Energy: 0.9143466447398199
Energy: 0.8780665919458136
Energy: 0.9191692105003947
Energy: 0.9606788663583381
Energy: 1.005829102144
Energy: 0.935748914192229
Energy: 0.8588842485346647
Energy: 0.9244988890583725
Energy: 0.9356496985451255
Energy: 0.8422923385843126
Energy: 0.9612734008653679
Energy: 0.9959619343328299
Energy: 0.8631467551526215
Energy: 0.960752840806801
Energy: 0.9967092239891264
Energy: 0.9208565325957699
Energy: 0.9614220037394671
Energy: 0.9602127802143957
Energy: 0.9144149279485275
Energy: 0.8775793997819796
Energy: 0.8773539583662118
Energy: 0.9602589639116498
Energy: 0.9444656186679667
Energy: 0.9069220835486705
Energy: 0.9224488888020611
Energy: 0.9120069417968836
Energy: 0.9178810415990049
Energy: 0.9250950126649075
Energy: 0.8319005543479636
Energy: 0.9165797559619326
Energy: 0.919713476753806
Energy: 0.8741598915967956
Energy: 0.8692336253856602
Energy: 0.9211834735735692
Energy: 0.8661203336264504
Energy: 0.8688796770553657
Energy: 0.8845693377241078
Energy: 0.8746799416156462
Energy: 0.8759305902704999
Energy: 0.875710210022896
Energy: 0.8753765745314696
Energy: 0.8938714179234574
Energy: 0.9062592887654058
Energy: 0.8699589742293011
Energy: 0.912580143041377
Energy: 0.8936421018473947
Energy: 0.8863632875459005
Energy: 0.8927926877491399
Energy: 0.9200043399314969
Energy: 0.9214033711816942
Energy: 0.9389599937119104
Energy: 0.8673179645634771
Energy: 0.9214269866285472
Energy: 0.9384468820891465
Energy: 0.9196826657210847
Energy: 0.9602985739688273
Energy: 0.9602572689594555
Energy: 0.8841636983204187
Energy: 0.9612880558451868
Energy: 0.9187321112101554
Energy: 0.9289058303082326
Energy: 0.9249624101920575
Energy: 0.8780251323023518
Energy: 0.9608984914244638
Energy: 0.9231794636268993
Energy: 0.8838938992915949
Energy: 1.030750423273546
Energy: 0.9603061591351746
Energy: 0.9641251268695503
Energy: 1.02989853850203
Energy: 0.9606249562573832
Energy: 0.9711053913424925
Energy: 0.9151479035430093
Energy: 0.9420859139219973
Energy: 0.8906723497736313
Energy: 0.9604455597455127
Energy: 0.9614215480229334
Energy: 0.9078694473621192
Energy: 0.8572038912031087
Energy: 0.9218022605875421
Energy: 0.9969514559101048
Energy: 0.9204744694018903
Energy: 0.9362414981143434
Energy: 0.9967527128122785

minimum gb energy = 0.8319005543479636 eV
minimum distance =  2.37612618306369 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.0406109756986446
Energy: 1.0108395341877054
Energy: 0.9832756195808473
Energy: 0.8463218189091417
Energy: 0.9066176887798395
Energy: 0.8278706344131923
Energy: 0.8107263502729675
Energy: 0.8812651819937583
Energy: 0.8807350827766786
Energy: 0.8941867331342831
Energy: 0.8878661748991876
Energy: 0.8024666962518823
Energy: 1.0581946567565115
Energy: 0.7980164406325256
Energy: 0.7983951009206867
Energy: 0.8906340306848504
Energy: 0.7967953007872881
Energy: 0.7979019462083649
Energy: 0.8870422923623474
Energy: 0.7967708025200616
Energy: 0.8041000921353542
Energy: 0.8868765804735549
Energy: 0.8114512230267703
Energy: 0.8967150131287375
Energy: 0.8939108923480173
Energy: 0.8041423459724
Energy: 0.8183276364226635
Energy: 0.8941705079146774
Energy: 0.8043364265291293
Energy: 0.8037831539034244
Energy: 0.8256575727472651
Energy: 0.794571551688282
Energy: 0.7947583860018542
Energy: 0.7768975415414081
Energy: 0.7916654569235155
Energy: 0.7768954420801584
Energy: 0.8559259024702118
Energy: 0.7914485398797637
Energy: 0.7915555148162006
Energy: 0.8658360487658346
Energy: 0.7917375802931204
Energy: 0.7931590826375978
Energy: 0.7916139211116154
Energy: 0.7964753205678827
Energy: 0.7879206337464599
Energy: 0.7994668298121386
Energy: 0.7997999230706525
Energy: 0.7992945939703212
Energy: 0.7931079496867034
Energy: 0.7910908638213541
Energy: 0.7899551451155636
Energy: 0.7913034644497494
Energy: 0.7883805626442579
Energy: 0.7918714922492591
Energy: 0.7920524162999334
Energy: 0.7939244741329419
Energy: 0.7944253046061565
Energy: 0.7919744919307642
Energy: 0.7935637128230768
Energy: 0.794863075726599
Energy: 0.9007369210092375
Energy: 0.811188312327746
Energy: 0.8108845549289214
Energy: 0.8047174774287824
Energy: 0.8938354044689324
Energy: 0.8103387723241608
Energy: 0.8557187262187187
Energy: 0.8873151907798956
Energy: 0.8872680389302082
Energy: 0.8676870920803353
Energy: 0.8873065507698452
Energy: 0.8972567658847269
Energy: 0.8027735715660876
Energy: 0.8906938713114292
Energy: 0.8909456313634074
Energy: 0.7928852414195287
Energy: 0.8815017945638189
Energy: 0.890234225490991
Energy: 0.9760988514670225
Energy: 0.8873644562570352
Energy: 0.8947470772072497
Energy: 0.8817622450586237
Energy: 0.8872747817474207
Energy: 0.8120185777693875
Energy: 0.976729584970503
Energy: 0.8764611121308462
Energy: 0.8799269970467528
Energy: 0.8899469981804045
Energy: 0.8864442270584637
Energy: 0.884141716111761
Energy: 1.042241310735207
Energy: 0.8892986151870848
Energy: 0.8415380736071058
Energy: 0.9614611901461908
Energy: 0.889364968132009
Energy: 0.8967183611055234
Energy: 0.7798344597757804
Energy: 0.8891941706394029
Energy: 0.9592759249466052
Energy: 0.8100791636299861
Energy: 0.8895261757639534
Energy: 0.9686806697044118

minimum gb energy = 0.7768954420801584 eV
minimum distance =  2.3363116560777 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.3875223578523155
Energy: 0.9363885554328
Energy: 0.7842487258236561
Energy: 0.7622913738829162
Energy: 1.044154191144279
Energy: 0.8131805987173472
Energy: 0.9348042676333459
Energy: 0.8526032414750226
Energy: 0.8321874090730655
Energy: 0.8446842949204845
Energy: 0.8371115485917877
Energy: 0.7283472083630841
Energy: 0.9915430055816268
Energy: 0.7169866098450358
Energy: 0.7314280300205375
Energy: 0.8359661542034936
Energy: 0.7171735069649331
Energy: 0.7592385564390173
Energy: 0.8471699400325482
Energy: 0.7342546847357367
Energy: 0.7583908843006029
Energy: 0.8480944857291824
Energy: 0.7769501324398902
Energy: 0.7796634675480993
Energy: 0.8450179613263353
Energy: 0.7531269804337801
Energy: 0.7546545771590271
Energy: 0.7647525307417977
Energy: 0.7525852628528129
Energy: 0.728460908988032
Energy: 0.8700696362494653
Energy: 0.7429872342156204
Energy: 0.7164116226608701
Energy: 0.7172256133551079
Energy: 0.7491214497328335
Energy: 0.716476218501506
Energy: 0.8874547930594836
Energy: 0.748458921919694
Energy: 0.7484602900933347
Energy: 0.72613579795615
Energy: 0.7511332256697512
Energy: 0.725291446490568
Energy: 0.8916460425108973
Energy: 0.7010797841127215
Energy: 0.7092585671013254
Energy: 0.7098904860505025
Energy: 0.7008751843642592
Energy: 0.7390948609686743
Energy: 0.7074788797110793
Energy: 0.709054772729632
Energy: 0.7103811745359004
Energy: 0.7087495310613203
Energy: 0.8646919532202128
Energy: 0.7067823668910365
Energy: 0.7069399454983663
Energy: 0.7057745910920208
Energy: 0.7053226872772633
Energy: 0.7065480852954892
Energy: 0.733642168917087
Energy: 0.70473861584124
Energy: 0.8639043138926933
Energy: 0.7063793541242329
Energy: 0.7045182321341467
Energy: 0.7311572606263063
Energy: 0.7068846397526124
Energy: 0.7043548271554378
Energy: 0.8704356087632625
Energy: 0.7067134292638405
Energy: 0.7065780076568859
Energy: 0.7976209739045002
Energy: 0.7113593099064346
Energy: 0.71513652789514
Energy: 0.795567917575628
Energy: 0.7378970030888506
Energy: 0.7378543325008784
Energy: 0.7093950957672853
Energy: 0.7134902054784626
Energy: 0.713107069888922
Energy: 0.7489445169565133
Energy: 0.7245594407532269
Energy: 0.7248267374810474
Energy: 0.749968376986121
Energy: 0.725513530645679
Energy: 0.7483796567256155
Energy: 0.7489962485105705
Energy: 0.7102320026020873
Energy: 0.7092661567141837
Energy: 0.7482065929042574
Energy: 0.7383108762013839
Energy: 0.741881372372678
Energy: 0.9222111262499454
Energy: 0.7658171276002897
Energy: 0.7538997452623089
Energy: 0.7529893582755947
Energy: 0.8443330923873736
Energy: 0.7549227087177891
Energy: 0.887435330121461
Energy: 0.8443092277240343
Energy: 0.8444100427922222
Energy: 0.7573899681170941
Energy: 0.8441569708212198
Energy: 0.7586011131198972
Energy: 0.8876809330240223
Energy: 0.8348535248136757
Energy: 0.821320701398354
Energy: 0.8108255456931964
Energy: 0.8357525811040317
Energy: 0.7548093420492845
Energy: 0.921780360650165
Energy: 0.8449829693071664
Energy: 0.790952282934983
Energy: 0.8398279122106813
Energy: 0.7664263966392988
Energy: 0.7550367936591774
Energy: 0.9914586239685937
Energy: 0.7515114121756967
Energy: 0.7539036582265053
Energy: 0.8485050140296345
Energy: 0.7543261859243979
Energy: 0.8376875205916021
Energy: 0.9712269801013532
Energy: 0.8452780104258064
Energy: 0.8494384340429955
Energy: 0.8362050241513406
Energy: 0.8446975336417171
Energy: 0.8445208634155261
Energy: 0.9047989767250829
Energy: 0.8404892097929546
Energy: 0.9070248214708342
Energy: 0.7323980239431643
Energy: 0.8403275462659628
Energy: 0.7809490256966086
Energy: 0.9050988461244762
Energy: 0.8534075028094408
Energy: 0.8211446454025323
Energy: 0.7402127136110105
Energy: 0.8396910848130419
Energy: 0.9062834565854024
Energy: 0.9731813180414126
Energy: 0.7759953806931056
Energy: 0.8314192870929894
Energy: 0.8459560522555291
Energy: 0.7380385703321349
Energy: 0.83429424573825
Energy: 0.8448755429056893
Energy: 0.7176320893096613
Energy: 0.7319456226554062
Energy: 0.8451872427239039
Energy: 0.7175740140340389
Energy: 0.7613406709529633
Energy: 0.844866524986514
Energy: 0.7651380032241762
Energy: 0.7672410543895127
Energy: 0.7639580508774962
Energy: 0.7638606615220199
Energy: 0.7677117770400407
Energy: 0.8702165871747269
Energy: 0.743367524038448
Energy: 0.7434538624816345
Energy: 0.7171518261055312
Energy: 0.7421675072533321
Energy: 0.7165623435522357
Energy: 0.8735672684649257
Energy: 0.7485603156916046
Energy: 0.7487533605129371
Energy: 0.8739383083549835
Energy: 0.7506850643408306
Energy: 0.7490950055509
Energy: 0.9086505608252663
Energy: 0.7151462948310194
Energy: 0.714430655865308
Energy: 0.7122297168517541
Energy: 0.7483769376984148
Energy: 0.7153019246481137
Energy: 0.7065782504174478
Energy: 0.7008995685396288
Energy: 0.7091471933206105
Energy: 0.7067357947371207
Energy: 0.700897179006685
Energy: 0.7090421735361828
Energy: 0.7112716792285199
Energy: 0.7086058158484985
Energy: 0.7074577887457025
Energy: 0.7121367701338355
Energy: 0.7048732979576343
Energy: 0.7138454488644749
Energy: 0.8637763425828022
Energy: 0.710267656905373
Energy: 0.7090487465687976
Energy: 0.7322449014706459
Energy: 0.704851089097005
Energy: 0.7097145661969774
Energy: 0.8633218769933342
Energy: 0.7116875050850076
Energy: 0.7065090861098581
Energy: 0.8644588900741653
Energy: 0.7077172180164223
Energy: 0.7066089961446658
Energy: 0.866780157783022
Energy: 0.7094443733840589
Energy: 0.7250141967271462
Energy: 0.7386345959393069
Energy: 0.7101098123012224
Energy: 0.7261096652643569
Energy: 0.7480984809725093
Energy: 0.72572074535132
Energy: 0.7252472357786586
Energy: 0.7483508748437806
Energy: 0.7152348691499665
Energy: 0.7268559703240393
Energy: 0.7481773335375612
Energy: 0.7093521637091829
Energy: 0.7278737069930973
Energy: 0.7484255734148785
Energy: 0.7095739765431338
Energy: 0.752739801100375
Energy: 0.9338392632419893
Energy: 0.7274175125545945
Energy: 0.7282563638632548
Energy: 0.7441136004305017
Energy: 0.7644926828024022
Energy: 0.7289582246120688
Energy: 0.8922074663914086
Energy: 0.8439056565749147
Energy: 0.8440545231825196
Energy: 0.7687414695249103
Energy: 0.8473206650822972
Energy: 0.7556363299444009
Energy: 0.8880328633146591
Energy: 0.8344984666468078
Energy: 0.7434034599711047
Energy: 0.7262764071211981
Energy: 0.8356811385314079
Energy: 0.7405847813181371
Energy: 0.9248788016231125
Energy: 0.8440859929997351
Energy: 0.8448556778816446
Energy: 0.7642665109812197
Energy: 0.8479901176866791
Energy: 0.8014968486841618
Energy: 0.9278579905987231
Energy: 0.7417381269000732
Energy: 0.8198106823050382
Energy: 0.8362447123143041
Energy: 0.7402495307025733
Energy: 0.8427050675586105
Energy: 0.9727335769360339
Energy: 0.7788544341533127
Energy: 0.8204419962791595
Energy: 0.8396328648388736
Energy: 0.7648197034838118
Energy: 0.8343536460520252
Energy: 0.9055242907370822
Energy: 0.8532851586383099
Energy: 0.8214111274430336
Energy: 0.7458730394441756
Energy: 0.8397303612519255
Energy: 0.906528074052008

minimum gb energy = 0.7008751843642592 eV
minimum distance =  2.34867428011223 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.8507987532073304
Energy: 0.8736029957015916
Energy: 0.7185390756620924
Energy: 0.6904192362408187
Energy: 0.9600109059125156
Energy: 0.7209617258438866
Energy: 0.8770568514287352
Energy: 0.8045018963855745
Energy: 0.7128725273873898
Energy: 0.8037100676471404
Energy: 0.8005686191241682
Energy: 0.6839264180098521
Energy: 0.9218745450262423
Energy: 0.6664963040572386
Energy: 0.6836077723338418
Energy: 0.8027911926260981
Energy: 0.6695171257551628
Energy: 0.6921167245746036
Energy: 0.7990658949813566
Energy: 0.6664497011266959
Energy: 0.7195594471031251
Energy: 0.800120651522298
Energy: 0.6655571584647002
Energy: 0.7414696918193461
Energy: 0.7865210729396406
Energy: 0.7118084331483956
Energy: 0.709920811385764
Energy: 0.7836583247382768
Energy: 0.70980274783748
Energy: 0.7011571163515706
Energy: 0.7944171880043632
Energy: 0.7113396538233165
Energy: 0.6638447560013441
Energy: 0.6471968944544046
Energy: 0.7102952969059162
Energy: 0.6666666487202626
Energy: 0.8343543453366505
Energy: 0.71762936233152
Energy: 0.7118578276988461
Energy: 0.664031522319011
Energy: 0.7130142684956391
Energy: 0.6787933586086731
Energy: 0.8348360529331211
Energy: 0.639726555305749
Energy: 0.6577823379655807
Energy: 0.6857700511984289
Energy: 0.6403237650312527
Energy: 0.668268949192713
Energy: 0.6656963081180978
Energy: 0.654895947992571
Energy: 0.667695289303276
Energy: 0.6654942807808845
Energy: 0.801947329765449
Energy: 0.6630944600944552
Energy: 0.6634154782778955
Energy: 0.6731373250732008
Energy: 0.6605418707589227
Energy: 0.6631875064325548
Energy: 0.6738018732214833
Energy: 0.659404516045561
Energy: 0.78898455550908
Energy: 0.6401941384374297
Energy: 0.6379939676094389
Energy: 0.6356798530816011
Energy: 0.6406942037035379
Energy: 0.652085070719838
Energy: 0.7948092884560377
Energy: 0.6473403053215013
Energy: 0.6401123620764296
Energy: 0.722306935942058
Energy: 0.6443698313462775
Energy: 0.6417669504603142
Energy: 0.7986894256748038
Energy: 0.6794048160205729
Energy: 0.67701788221173
Energy: 0.644840592593751
Energy: 0.6825235733199314
Energy: 0.6603148877049747
Energy: 0.6409656237743571
Energy: 0.6418346804608824
Energy: 0.6486848581531437
Energy: 0.6426331176713216
Energy: 0.795393363405128
Energy: 0.6401287615954193
Energy: 0.6402911604081963
Energy: 0.6369009438673139
Energy: 0.6365998601141064
Energy: 0.640256836215572
Energy: 0.6648188080834306
Energy: 0.6384755723238851
Energy: 0.8103548248891884
Energy: 0.6627047923121931
Energy: 0.6571344817978808
Energy: 0.6857189436429831
Energy: 0.6716981916584992
Energy: 0.6553822377100732
Energy: 0.7987976458774558
Energy: 0.6629478080189363
Energy: 0.6628335052218419
Energy: 0.6397897925950625
Energy: 0.6689044820584059
Energy: 0.6665264949846088
Energy: 0.8069928277962259
Energy: 0.6807987053974117
Energy: 0.6640839367426943
Energy: 0.8072474095964484
Energy: 0.6826041599681788
Energy: 0.6667668257642656
Energy: 0.7101340244615418
Energy: 0.6813193734537794
Energy: 0.7118516995481026
Energy: 0.7118043996617952
Energy: 0.6805495260291176
Energy: 0.711899540775139
Energy: 0.8662091756382879
Energy: 0.682469462298536
Energy: 0.6815517774060931
Energy: 0.7046723244127969
Energy: 0.6563413020370158
Energy: 0.6848539461415754
Energy: 0.866422818459225
Energy: 0.7098411559717864
Energy: 0.7111749539284874
Energy: 0.706238667691763
Energy: 0.8058217534405312
Energy: 0.711676331233414
Energy: 0.8055430103503642
Energy: 0.7975822160682257
Energy: 0.7119517388531938
Energy: 0.6592218994743787
Energy: 0.8065958957711439
Energy: 0.6817316266090483
Energy: 0.8014959454541412
Energy: 0.7986244513629801
Energy: 0.7493435731604601
Energy: 0.7211144335051453
Energy: 0.8031671521953201
Energy: 0.7692556250638345
Energy: 0.8667564234514931
Energy: 0.7079161476397461
Energy: 0.6818583747259823
Energy: 0.7883434985907154
Energy: 0.7213164404148817
Energy: 0.6979267270073396
Energy: 0.9240254363063267
Energy: 0.6867747985892872
Energy: 0.6881079057119556
Energy: 0.7888383386995574
Energy: 0.6809922976883903
Energy: 0.7728206691108545
Energy: 0.9120557130988382
Energy: 0.8032093136965739
Energy: 0.7762304876041509
Energy: 0.8018389688274072
Energy: 0.8031379279461142
Energy: 0.7108426371768388
Energy: 0.8158340889062433
Energy: 0.780186304567194
Energy: 0.7413047445109749
Energy: 0.6722081393348329
Energy: 0.7879442215793044
Energy: 0.6919421207232476

minimum gb energy = 0.6356798530816011 eV
minimum distance =  2.39136734660569 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.7420526156506212
Energy: 0.6981110277675622
Energy: 0.622442148507244
Energy: 0.5816948731442332
Energy: 0.8222350024933192
Energy: 0.6045136611242214
Energy: 0.741640451970616
Energy: 0.6834540602044862
Energy: 0.6872857870812566
Energy: 0.6837617636014062
Energy: 0.6861297779309476
Energy: 0.5598332375578171
Energy: 0.7806342842375827
Energy: 0.5445100939519847
Energy: 0.5606391433785325
Energy: 0.6833396136227011
Energy: 0.5448450262625438
Energy: 0.5611506809242031
Energy: 0.6862821400194783
Energy: 0.5604134852710623
Energy: 0.5610077731275409
Energy: 0.6834602563950479
Energy: 0.5442054903771614
Energy: 0.641225919512625
Energy: 0.672026236693153
Energy: 0.5981195175754089
Energy: 0.6005400778682283
Energy: 0.6721014479864461
Energy: 0.630366685801444
Energy: 0.6009223967981078
Energy: 0.6752274671146802
Energy: 0.6178479895883265
Energy: 0.5512265252078995
Energy: 0.5309359064292425
Energy: 0.6178084304816219
Energy: 0.5386967647794979
Energy: 0.7158926105562476
Energy: 0.6180485617818198
Energy: 0.6179503844095535
Energy: 0.5525100079798353
Energy: 0.6181834310880686
Energy: 0.5912495896726142
Energy: 0.7132190848408445
Energy: 0.5269294373630496
Energy: 0.5322434602425904
Energy: 0.5628425653862541
Energy: 0.5267979735265594
Energy: 0.5323209339828207
Energy: 0.5782731728488183
Energy: 0.531624105807811
Energy: 0.5767767483248636
Energy: 0.5798797877012585
Energy: 0.6847821169687077
Energy: 0.5766458775232186
Energy: 0.5607919855896994
Energy: 0.53712599456429
Energy: 0.5367819217738563
Energy: 0.5774444374151901
Energy: 0.5377035553641077
Energy: 0.5365841138004441
Energy: 0.6697967859014828
Energy: 0.5510484417187903
Energy: 0.5251553825251611
Energy: 0.5212079319427546
Energy: 0.5509023857151983
Energy: 0.5227269909564045
Energy: 0.6808611438548251
Energy: 0.550635286476437
Energy: 0.5503786484857045
Energy: 0.5366540408071117
Energy: 0.5512627076834834
Energy: 0.5367014319353304
Energy: 0.6827575937769248
Energy: 0.5441011912654465
Energy: 0.5497703714988519
Energy: 0.5502387887709252
Energy: 0.5193541468690851
Energy: 0.5519228131160794
Energy: 0.5365785763997364
Energy: 0.520467536483386
Energy: 0.5348729411234378
Energy: 0.5369265718314408
Energy: 0.6740253309758576
Energy: 0.5354437463193747
Energy: 0.5353858445315436
Energy: 0.5218834277654304
Energy: 0.5222360376276467
Energy: 0.5358539453884338
Energy: 0.5428866789063531
Energy: 0.5232567849813136
Energy: 0.6706948830839533
Energy: 0.5280915129074462
Energy: 0.5300923981562401
Energy: 0.5179022059589218
Energy: 0.528082565808861
Energy: 0.5153925383213183
Energy: 0.671042834790056
Energy: 0.5280900962428897
Energy: 0.5277581999909818
Energy: 0.52032126873811
Energy: 0.5280251032616464
Energy: 0.5229378510082244
Energy: 0.6737346273232961
Energy: 0.54056129614087
Energy: 0.5403072548665044
Energy: 0.6715888297660257
Energy: 0.5387374940126989
Energy: 0.5203512151476699
Energy: 0.5286565142149477
Energy: 0.6729624185702785
Energy: 0.5276727007828997
Energy: 0.5291909975208806
Energy: 0.6750608690273505
Energy: 0.528176727237445
Energy: 0.675805981379493
Energy: 0.5417169357052523
Energy: 0.5436911588658231
Energy: 0.6058093902891164
Energy: 0.5416216934815029
Energy: 0.5272542149848773
Energy: 0.6775948859573084
Energy: 0.5352597206919659
Energy: 0.5349736842215932
Energy: 0.536634170207965
Energy: 0.5353607563202123
Energy: 0.5284966285579505
Energy: 0.6887860514955093
Energy: 0.5351870936535553
Energy: 0.5354317069422874
Energy: 0.5178455096786503
Energy: 0.5352851672567741
Energy: 0.5174736357154436
Energy: 0.5512336608666645
Energy: 0.5234663257335306
Energy: 0.5229460301758647
Energy: 0.5515210246682476
Energy: 0.5365590711559448
Energy: 0.5261024514237665
Energy: 0.5513431239680764
Energy: 0.534633582543906
Energy: 0.5503551946305545
Energy: 0.5521992817177901
Energy: 0.6816761750949026
Energy: 0.5503610663190018
Energy: 0.6937757934070689
Energy: 0.5380943830146191
Energy: 0.5443243486776165
Energy: 0.565216640177814
Energy: 0.5225714831836668
Energy: 0.5435095777682233
Energy: 0.6929799536122365
Energy: 0.5769510181379663
Energy: 0.5768032441048535
Energy: 0.5494933329421072
Energy: 0.5770678813954027
Energy: 0.5493290696161003
Energy: 0.6728135666915869
Energy: 0.5767695804590265
Energy: 0.5408826036861913
Energy: 0.5258136272374568
Energy: 0.5767282622244367
Energy: 0.5306969179812522
Energy: 0.6017838157739532
Energy: 0.5471593450862071
Energy: 0.5403045351917172
Energy: 0.6189160284643227
Energy: 0.5447647055626924
Energy: 0.5404057073784051
Energy: 0.6191338782436874
Energy: 0.5449985752871952
Energy: 0.6180485847720971
Energy: 0.6205714818809115
Energy: 0.6934924362534395
Energy: 0.6180380343434208
Energy: 0.7426883620262631
Energy: 0.5359249038119736
Energy: 0.546525495738501
Energy: 0.599611555089245
Energy: 0.535614608028867
Energy: 0.5467213596129382
Energy: 0.7351446912045279
Energy: 0.6831243142646406
Energy: 0.5988360918413382
Energy: 0.5992935093642665
Energy: 0.6850930858521359
Energy: 0.600719567953036
Energy: 0.6816501410065873
Energy: 0.6829049255520707
Energy: 0.5729566372970895
Energy: 0.5399503652464599
Energy: 0.6829363451094277
Energy: 0.5529532299075202
Energy: 0.6817214315623912
Energy: 0.6468164407148457
Energy: 0.6471111779996717
Energy: 0.6014192627508604
Energy: 0.6572681949117776
Energy: 0.5986079121491871
Energy: 0.7339410627590227
Energy: 0.5694054558602133
Energy: 0.5793292070006033
Energy: 0.6833518881343463
Energy: 0.5685598526266857
Energy: 0.6572583066232546
Energy: 0.7737287341259
Energy: 0.5603286510485556
Energy: 0.5796717216878201
Energy: 0.6834894256154302
Energy: 0.5596039599639334
Energy: 0.604650921137479
Energy: 0.7416404598436993
Energy: 0.6434612515765656
Energy: 0.6475111606046567
Energy: 0.6834915292678985
Energy: 0.6869477410137032
Energy: 0.5982972761909952

minimum gb energy = 0.5153925383213183 eV
minimum distance =  2.37329083394539 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.034112367739274445
Energy: 0.06496259311798522
Energy: 0.03451678131592049
Energy: 0.03594959280745437
Energy: 0.0652740281791239
Energy: 0.034434062569989786
Energy: 0.06628644472301498
Energy: 0.03497447625203046
Energy: 0.03577152304192991
Energy: 0.06530932509670807
Energy: 0.03539507157485888
Energy: 0.03535797433250073
Energy: 0.06520329319218353
Energy: 0.034523237742609625
Energy: 0.03456013312362715
Energy: 0.06509587288758396
Energy: 0.03447820753704396
Energy: 0.06543273143048053
Energy: 0.03700854596182155
Energy: 0.034552856751211745
Energy: 0.034551201368737905
Energy: 0.035206160319415515
Energy: 0.03444817437046668
Energy: 0.0661020383150515
Energy: 0.06551566535041904
Energy: 0.06513976321691005
Energy: 0.06505556917491516
Energy: 0.06660341698224914
Energy: 0.06529772612393314
Energy: 0.06507540530969813
Energy: 0.03496336357334607
Energy: 0.035136461112219616
Energy: 0.034707435518769626
Energy: 0.03609154116859897
Energy: 0.03528096369369786
Energy: 0.034491261200671496
Energy: 0.06525282110666764
Energy: 0.03526882242124851
Energy: 0.03540662360910027
Energy: 0.06522818869144476
Energy: 0.03628052997627855
Energy: 0.03528553579645123
Energy: 0.06515404904297518
Energy: 0.03447859855222684
Energy: 0.0345044173858384
Energy: 0.06517956317167832
Energy: 0.034656326704065106
Energy: 0.06571556997166084
Energy: 0.03576141786810243
Energy: 0.03451954169060954
Energy: 0.0669206017487128
Energy: 0.036324063818760334
Energy: 0.03457748225088095
Energy: 0.06718434936016757
Energy: 0.034661421869223094
Energy: 0.0651102043763007
Energy: 0.0650612165990502
Energy: 0.03462420414041705
Energy: 0.06506750799676841
Energy: 0.06495279679493808

minimum gb energy = 0.034112367739274445 eV
minimum distance =  2.5333651535721 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.6286686120724533
Energy: 0.6422124320023376
Energy: 0.6213606460936537
Energy: 0.6062408062760477
Energy: 0.6420169025620951
Energy: 0.620791526073741
Energy: 0.6574003241590779
Energy: 0.6642303375682268
Energy: 0.6644257653388902
Energy: 0.6322175340843358
Energy: 0.6744029303156613
Energy: 0.6642899331688775
Energy: 0.6952368032456163
Energy: 0.598735447660767
Energy: 0.5962877210500901
Energy: 0.673294661756027
Energy: 0.614185312025777
Energy: 0.6207299344517883
Energy: 0.6689584727650222
Energy: 0.5961501600190252
Energy: 0.6116850233105767
Energy: 0.6690255317255346
Energy: 0.5960873948571013
Energy: 0.6547211110123737
Energy: 0.6144853125862261
Energy: 0.6647653075561757
Energy: 0.6642248993345444
Energy: 0.6143931722924055
Energy: 0.6706376417934616
Energy: 0.6642957183091747
Energy: 0.5895074619331859
Energy: 0.6329254606241276
Energy: 0.6210963105351534
Energy: 0.5816529360388071
Energy: 0.6332345580657905
Energy: 0.5817262437308294
Energy: 0.6327286627166326
Energy: 0.6406633562423398
Energy: 0.6210236801230307
Energy: 0.6339834110139153
Energy: 0.6416703150094275
Energy: 0.6384853751597959
Energy: 0.6675919932996411
Energy: 0.5883482911277702
Energy: 0.5916445045260509
Energy: 0.6678089940426937
Energy: 0.5599722500395578
Energy: 0.581649153917758
Energy: 0.6279534842670852
Energy: 0.5909959064007486
Energy: 0.6316542598971513
Energy: 0.6360748244027891
Energy: 0.6138011755145287
Energy: 0.6324068080152021
Energy: 0.6238803943561989
Energy: 0.6198851023526306
Energy: 0.5834639557450474
Energy: 0.6239348671317394
Energy: 0.6452618978786733
Energy: 0.5907885682618971
Energy: 0.5831857031049696
Energy: 0.6009087133069915
Energy: 0.6009347040095394
Energy: 0.5661825275893664
Energy: 0.5902432187323382
Energy: 0.5662168901583463
Energy: 0.5512084150831805
Energy: 0.602466145898246
Energy: 0.601129694081114
Energy: 0.5524247978877046
Energy: 0.604362233338519
Energy: 0.5500015776565713
Energy: 0.5989525984853301
Energy: 0.5538330927559534
Energy: 0.5734869418369816
Energy: 0.5988227833409846
Energy: 0.5541358234178965
Energy: 0.5635984310593658
Energy: 0.5741263379487966
Energy: 0.6147936083370534
Energy: 0.5762922309636247
Energy: 0.5762760960459449
Energy: 0.5581912831273103
Energy: 0.5775687053932098
Energy: 0.5719781419601383
Energy: 0.5353895284537851
Energy: 0.5340490066254484
Energy: 0.5720572449192096
Energy: 0.5737525017062102
Energy: 0.5327556289917977
Energy: 0.5702246371968318
Energy: 0.5616541630310095
Energy: 0.5612799259602355
Energy: 0.559476624363784
Energy: 0.5695975630202219
Energy: 0.561664921940005
Energy: 0.5283212527708795
Energy: 0.5662933035296485
Energy: 0.5647744024571778
Energy: 0.5285500510812562
Energy: 0.5593864258762603
Energy: 0.5282165564318161
Energy: 0.5363940824318048
Energy: 0.5531417228815767
Energy: 0.5546354163517035
Energy: 0.5364710724610425
Energy: 0.5533587962691847
Energy: 0.5547558000034816
Energy: 0.562530764879348
Energy: 0.5650126663529401
Energy: 0.5545503998385825
Energy: 0.5534767476929471
Energy: 0.5654267957294934
Energy: 0.5544947620726564
Energy: 0.5646973459336637
Energy: 0.5311701036119143
Energy: 0.53205145724363
Energy: 0.5661086139411566
Energy: 0.5295872821320503
Energy: 0.5289450770689041
Energy: 0.5653076584285969
Energy: 0.5599303220851894
Energy: 0.5612183523279137
Energy: 0.5669966466553569
Energy: 0.5714238848473339
Energy: 0.561752092614215
Energy: 0.573935975568598
Energy: 0.559852801637368
Energy: 0.5632733501161029
Energy: 0.5660034654407992
Energy: 0.5576477603314378
Energy: 0.5340258476171054
Energy: 0.5328241515723072
Energy: 0.5768059680216979
Energy: 0.5766425878321075
Energy: 0.5327511960718606
Energy: 0.5751886405594462
Energy: 0.5762584180107363
Energy: 0.5761658166924711
Energy: 0.600689685889347
Energy: 0.5762136578199932
Energy: 0.5612273286555811
Energy: 0.6018851358980709
Energy: 0.5616082466893109
Energy: 0.594087244252458
Energy: 0.5527100136993599
Energy: 0.5499823613693929
Energy: 0.595210638270672
Energy: 0.5801520880974367
Energy: 0.5501011629743797
Energy: 0.5956639410525728
Energy: 0.5787635740230962
Energy: 0.5817128655681748
Energy: 0.5964717841980711
Energy: 0.5544209907937073
Energy: 0.6008912890484829
Energy: 0.6426957116055967
Energy: 0.5814673012358992
Energy: 0.5818101257676404
Energy: 0.6442386961135581
Energy: 0.6000815015617308
Energy: 0.5849595245329988
Energy: 0.5608007061313054
Energy: 0.6338590931948934
Energy: 0.6317803848848691
Energy: 0.5608718527430632
Energy: 0.632895660778409
Energy: 0.6319359514378816
Energy: 0.5893182002641798
Energy: 0.6592665064613618
Energy: 0.6133115598510879
Energy: 0.5729721552239925
Energy: 0.6623154117015776
Energy: 0.5724814543616359
Energy: 0.6219154272358983
Energy: 0.6274645508545798
Energy: 0.6256657110648611
Energy: 0.6220218232924135
Energy: 0.6263214111409646
Energy: 0.633152893560476
Energy: 0.6555065726321352
Energy: 0.5972706867176492
Energy: 0.5970289645538319
Energy: 0.6555225348958791
Energy: 0.5644071540058994
Energy: 0.5991365726663788
Energy: 0.7008696297617273
Energy: 0.598970641544416
Energy: 0.6425749205834985
Energy: 0.6757004730465911
Energy: 0.580137243474379
Energy: 0.6257272490024193
Energy: 0.5922972290995335
Energy: 0.6272504564986071
Energy: 0.6257241112823012
Energy: 0.5922449128558996
Energy: 0.6685744436097517
Energy: 0.6390175966024197

minimum gb energy = 0.5282165564318161 eV
minimum distance =  2.29889184977203 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.7483620322264158
Energy: 0.7489499112704668
Energy: 0.8156811129022816
Energy: 0.7199474207190882
Energy: 0.7181627615319549
Energy: 0.7467200202075878
Energy: 0.761334977732074
Energy: 0.7703484346397764
Energy: 0.7650576433616998
Energy: 0.7797257246222831
Energy: 0.7791432397747655
Energy: 0.7649829173484716
Energy: 0.8151438404136956
Energy: 0.7177552737063057
Energy: 0.7273080097548497
Energy: 0.7776984793207092
Energy: 0.7144254102818134
Energy: 0.7269869489813681
Energy: 0.7356016978220545
Energy: 0.7273103064269246
Energy: 0.7274706772170721
Energy: 0.7361001809634462
Energy: 0.7129665280771345
Energy: 0.7635726349370277
Energy: 0.7294223685588493
Energy: 0.7711898081183535
Energy: 0.7741456956702004
Energy: 0.7296303969336739
Energy: 0.7805583935699875
Energy: 0.764932759008646
Energy: 0.7003911368675831
Energy: 0.7314344470014601
Energy: 0.722115762856268
Energy: 0.7197615747588954
Energy: 0.7322850329266349
Energy: 0.7214536336730268
Energy: 0.7352876097952716
Energy: 0.7250634466004812
Energy: 0.729117805783703
Energy: 0.7326036337824314
Energy: 0.7224840879054717
Energy: 0.7206856601531645
Energy: 0.7638224613803611
Energy: 0.6972082480528179
Energy: 0.6970708733046425
Energy: 0.7533085378540427
Energy: 0.6971015488434074
Energy: 0.7215139398873852
Energy: 0.7185302468379754
Energy: 0.7336301183939139
Energy: 0.729606726267671
Energy: 0.7319057796885197
Energy: 0.7423219413265253
Energy: 0.7357927672208497
Energy: 0.7195860736099745
Energy: 0.7336808147948249
Energy: 0.7014586541780244
Energy: 0.7192623447286342
Energy: 0.7318487573926903
Energy: 0.7108705513940066
Energy: 0.7140978101510309
Energy: 0.7035521893198351
Energy: 0.707092974709388
Energy: 0.7035946778204584
Energy: 0.6916606361053182
Energy: 0.7081217764256085
Energy: 0.6793357418229873
Energy: 0.7078875174888539
Energy: 0.7017120185077174
Energy: 0.6766663605729046
Energy: 0.7118782975541457
Energy: 0.6755325339695866
Energy: 0.6937189481931009
Energy: 0.6941005938552284
Energy: 0.6933430254849169
Energy: 0.6933938699988125
Energy: 0.6912497146121299
Energy: 0.6761789498315715
Energy: 0.6873058932280909
Energy: 0.6925817377020363
Energy: 0.6936744272765027
Energy: 0.6909065120696685
Energy: 0.6892764062950368
Energy: 0.6931439234961145
Energy: 0.6923942029351183
Energy: 0.6988051335148491
Energy: 0.7030083125105059
Energy: 0.6938112210617018
Energy: 0.6946985430552811
Energy: 0.6758920596619256
Energy: 0.694127869574498
Energy: 0.7062995306556579
Energy: 0.7040376477815793
Energy: 0.7049725367773735
Energy: 0.7472964680472206
Energy: 0.7021727812708881
Energy: 0.7305968559388479
Energy: 0.6853973446967201
Energy: 0.6951588013020115
Energy: 0.7314786809958406
Energy: 0.6858641390310684
Energy: 0.7020212069009331
Energy: 0.6824991835332289
Energy: 0.72899689203112
Energy: 0.7311130509143889
Energy: 0.6818728009511795
Energy: 0.7290207648319542
Energy: 0.6812355933102429
Energy: 0.6875902127675702
Energy: 0.7143426659501105
Energy: 0.7109767246945011
Energy: 0.7107908814515813
Energy: 0.713940519445385
Energy: 0.7105912953178892
Energy: 0.71554127034593
Energy: 0.7235785579489663
Energy: 0.7208974427038412
Energy: 0.7154880556132089
Energy: 0.7631814280986458
Energy: 0.7330563701942736
Energy: 0.7182054028969983
Energy: 0.7413475720724081
Energy: 0.7414018945402764
Energy: 0.7184942123336164
Energy: 0.7276060419709766
Energy: 0.7416881185731569
Energy: 0.8276355868261153
Energy: 0.7041163774420026
Energy: 0.7420051006783519
Energy: 0.776900461142962
Energy: 0.7040195335197074
Energy: 0.7416659640348136
Energy: 0.7610918371492847
Energy: 0.7238691574276892
Energy: 0.7268635754845539
Energy: 0.7550525837268682
Energy: 0.7330117591140075
Energy: 0.7205822805906286

minimum gb energy = 0.6755325339695866 eV
minimum distance =  2.30739580632402 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.8619540252872645
Energy: 0.8719433252633825
Energy: 0.8681045296139706
Energy: 0.8316858056861687
Energy: 0.8471467822886192
Energy: 0.8359445448371483
Energy: 0.8301630271249739
Energy: 0.8373939717931592
Energy: 0.8343549952080525
Energy: 0.8503680253366053
Energy: 0.8517444601040514
Energy: 0.8351058283662472
Energy: 0.9454479817824806
Energy: 0.8302665857265175
Energy: 0.8293865160815558
Energy: 0.8352180474430586
Energy: 0.8119949943214856
Energy: 0.8293119439823016
Energy: 0.8902727484936134
Energy: 0.8298742505848112
Energy: 0.8294618175140561
Energy: 0.8348983924331957
Energy: 0.858782884884014
Energy: 0.8293044154546344
Energy: 0.8035134196377663
Energy: 0.8382882437353039
Energy: 0.8348216314439909
Energy: 0.8041672846770669
Energy: 0.8535130568957464
Energy: 0.8349062242502868
Energy: 0.8047656316216486
Energy: 0.8357984481666642
Energy: 0.8362370329978076
Energy: 0.7927603925665695
Energy: 0.8298637961420187
Energy: 0.7926243343722474
Energy: 0.804960418847855
Energy: 0.8358232816159887
Energy: 0.835142031657596
Energy: 0.8036057215977009
Energy: 0.8357782424443014
Energy: 0.7919423233207655
Energy: 0.856028429782874
Energy: 0.7968533601997735
Energy: 0.7970151730342583
Energy: 0.8072627520732301
Energy: 0.7960373845791485
Energy: 0.8108252413315045
Energy: 0.7858783689884262
Energy: 0.7970675634373188
Energy: 0.7971739276622153
Energy: 0.7996678030159822
Energy: 0.8250124624620511
Energy: 0.7976035396730345
Energy: 0.7863906540992206
Energy: 0.7962237817712815
Energy: 0.7724549621837873
Energy: 0.7871923150215583
Energy: 0.7928134642918625
Energy: 0.7804532724866081
Energy: 0.7812333064374519
Energy: 0.8418941632550101
Energy: 0.7880760312856012
Energy: 0.7865680406009435
Energy: 0.8284412374714721
Energy: 0.7872196691726749
Energy: 0.78743003064784
Energy: 0.7866568452962617
Energy: 0.786626568760831
Energy: 0.7876059422311605
Energy: 0.7815862754683192
Energy: 0.7894223060946841
Energy: 0.7726099645471269
Energy: 0.7970656768760955
Energy: 0.7979752314114458
Energy: 0.773278018657326
Energy: 0.7989097370616611
Energy: 0.774913182105671
Energy: 0.7909584346213581
Energy: 0.7972706963139579
Energy: 0.7966517918275027
Energy: 0.7829642698504067
Energy: 0.7865696464390769
Energy: 0.7825967357223809
Energy: 0.7917639657821283
Energy: 0.8118272289379023
Energy: 0.7977998160283073
Energy: 0.793906050394885
Energy: 0.8111225737738069
Energy: 0.7986031130440372
Energy: 0.832090390320527
Energy: 0.8034148050339187
Energy: 0.8035723011486107
Energy: 0.834894070531249
Energy: 0.8155986252125933
Energy: 0.835070037158124
Energy: 0.9441680961041882
Energy: 0.8045039860487798
Energy: 0.8044318520119976
Energy: 0.8349339604260201
Energy: 0.8043443842502018
Energy: 0.8040913299737855
Energy: 0.8886810634942067
Energy: 0.8379654776317564
Energy: 0.8362181821153114
Energy: 0.8366685553936185
Energy: 0.8512725657912131
Energy: 0.8181551662737611
Energy: 0.8103387621780984
Energy: 0.8352515925435602
Energy: 0.8602215882276646
Energy: 0.80139119963401
Energy: 0.8885177252407755
Energy: 0.8005107882633165
Energy: 0.8299998094044144
Energy: 0.8374172805597652
Energy: 0.8352748106625886
Energy: 0.8187135400111503
Energy: 0.8350977166814505
Energy: 0.8344784694606779
Energy: 0.9446003091656332
Energy: 0.8299803251199717
Energy: 0.8297475488567335
Energy: 0.8861322361014767
Energy: 0.8141094432161015
Energy: 0.8294347479882413
Energy: 0.8899692584432811
Energy: 0.8301324501263095
Energy: 0.8296883682367817
Energy: 0.8885830874347117
Energy: 0.8118379609574784
Energy: 0.8292073291986672
Energy: 0.8677885321710025
Energy: 0.8383102987644387
Energy: 0.8340467177109844
Energy: 0.8033619705816053
Energy: 0.8518625266127714
Energy: 0.8358701234655103
Energy: 0.8041142850329226
Energy: 0.8193734028032675
Energy: 0.8367244535313945
Energy: 0.792627974224267
Energy: 0.8185105920474609
Energy: 0.7926321850214204
Energy: 0.8048115911488161
Energy: 0.8341810193810894
Energy: 0.8352356640477289
Energy: 0.7920339869416603
Energy: 0.8350852293526444
Energy: 0.8122190785328967
Energy: 0.856676588157278
Energy: 0.7967573763163893
Energy: 0.7971167047632082
Energy: 0.8560886755266607
Energy: 0.7964705356813447
Energy: 0.8108674054481262
Energy: 0.7863840624409837
Energy: 0.7966789722336419
Energy: 0.7971179020158404
Energy: 0.7945825881713069
Energy: 0.7875271673822354
Energy: 0.7978473594740804
Energy: 0.785699284882785
Energy: 0.7921405322065501
Energy: 0.7730957788371783
Energy: 0.7857160088425003
Energy: 0.7941405194900351
Energy: 0.7809135045670085
Energy: 0.784271316152465
Energy: 0.7845036663992211
Energy: 0.7867217262238039
Energy: 0.7865094137846991
Energy: 0.7876504007352924
Energy: 0.7868651289987642
Energy: 0.7869264906223958
Energy: 0.786573597130654
Energy: 0.7867230372192157
Energy: 0.7872040394461133
Energy: 0.7913405428605554
Energy: 0.7921717171133736
Energy: 0.7918543612562796
Energy: 0.7955053697004526
Energy: 0.7875011552773996
Energy: 0.7921051187671059
Energy: 0.7976322329260868
Energy: 0.7744347019026934
Energy: 0.790904801202691
Energy: 0.7971699328858682
Energy: 0.7965099982447331
Energy: 0.7833032145179613
Energy: 0.7876154591313341
Energy: 0.7851147881637183
Energy: 0.7947819839311361
Energy: 0.8121359778721942
Energy: 0.7911713641246038
Energy: 0.7912203066946665
Energy: 0.8076732950970098
Energy: 0.7974223403401468
Energy: 0.847733155028544
Energy: 0.8036336289341041
Energy: 0.8099745715983647
Energy: 0.8547973631811454
Energy: 0.7679071214071163
Energy: 0.8130043382757159
Energy: 0.9439801040293974
Energy: 0.8041892769833002
Energy: 0.804329273193856
Energy: 0.8350855525181298
Energy: 0.7772215630583682
Energy: 0.8040923604605196
Energy: 0.8870482103551529
Energy: 0.8381346881221533
Energy: 0.8372982099365566
Energy: 0.8508197522887255
Energy: 0.8515971078992581
Energy: 0.8354788878372407
Energy: 0.8106697760409873
Energy: 0.835605566779827
Energy: 0.8598873210948801
Energy: 0.8012884496318194
Energy: 0.8885089499442244
Energy: 0.8008550452643352

minimum gb energy = 0.7679071214071163 eV
minimum distance =  2.33070366569017 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.2026913481100403
Energy: 0.9902794631169765
Energy: 0.9934467264599905
Energy: 0.9205936282203191
Energy: 0.9667647079621025
Energy: 0.9863158141898825
Energy: 0.9471491886272051
Energy: 0.9266393763634494
Energy: 0.9283890592043887
Energy: 0.9313107904094275
Energy: 0.974074373580815
Energy: 0.9264639595561465
Energy: 1.0432491008604576
Energy: 0.9229929013009815
Energy: 0.9223758987301952
Energy: 0.9658717439856098
Energy: 0.9225792087735103
Energy: 0.9222047350999999
Energy: 0.9635846118746422
Energy: 0.9224668498125376
Energy: 0.9221730585031913
Energy: 0.9641315084044619
Energy: 0.9232042955513229
Energy: 0.9090342183488287
Energy: 0.9286074307233819
Energy: 0.9272341279439323
Energy: 0.9299488805079703
Energy: 0.9052619162937665
Energy: 0.9743008414456416
Energy: 0.9326766450335359
Energy: 0.9218078139662549
Energy: 0.92655513325361
Energy: 0.9333370832581943
Energy: 0.9023861226935611
Energy: 0.926702360869947
Energy: 0.9324747308875191
Energy: 0.9281153459888662
Energy: 0.9672213347020068
Energy: 0.9279433535552969
Energy: 0.905807156087226
Energy: 0.9668345135927332
Energy: 0.9057191537974487
Energy: 0.9384235140358335
Energy: 0.9111894039623095
Energy: 0.9100513590873864
Energy: 0.9392435061938709
Energy: 0.9061727039528984
Energy: 0.909598219043642
Energy: 0.9006147214923835
Energy: 0.9125085329859467
Energy: 0.9108269072351541
Energy: 0.9003357246235544
Energy: 0.9225988125028074
Energy: 0.9097867163193194
Energy: 0.9271520748252428
Energy: 0.9058894688752281
Energy: 0.9090014943000455
Energy: 0.9178367718781376
Energy: 0.9384958457903798
Energy: 0.9132189426094204
Energy: 0.9298934454062372
Energy: 0.9040119951396102
Energy: 0.9321533260559238
Energy: 0.929926228640781
Energy: 0.9296418955642665
Energy: 0.9293346641956196
Energy: 1.0388361696397659
Energy: 0.9076222646693891
Energy: 0.9069756112310539
Energy: 0.9635457900251276
Energy: 0.9263639158477386
Energy: 0.9068315447068047
Energy: 1.02676674950981
Energy: 0.9304310268908491
Energy: 0.9312371770881147
Energy: 0.929602200682116
Energy: 0.9296552476172057
Energy: 0.927108874050761
Energy: 1.0913162751676615
Energy: 0.961668344316687
Energy: 0.9435347861033406
Energy: 0.8947043951189457
Energy: 0.9611877622935027
Energy: 0.9437784269771675

minimum gb energy = 0.8947043951189457 eV
minimum distance =  2.35777089354207 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.5147127550616255
Energy: 1.20167870963322
Energy: 1.1107309927916453
Energy: 1.0385675163567014
Energy: 1.0702837124238433
Energy: 1.0379569939974382
Energy: 1.1565059628039487
Energy: 1.0392305509700088
Energy: 1.0349354855486412
Energy: 1.0121793723471038
Energy: 1.0503810353459058
Energy: 1.048640198954313
Energy: 1.2137585098179924
Energy: 0.994809546861653
Energy: 0.994226679699255
Energy: 1.003838909336192
Energy: 0.9945736232257343
Energy: 1.0049046832651074
Energy: 1.00873039541996
Energy: 0.9957866496119113
Energy: 0.997282624052528
Energy: 1.008878562367818
Energy: 0.9942108254986227
Energy: 1.0048320873097927
Energy: 1.0336905482852587
Energy: 1.0383872364609275
Energy: 1.0168572041886947
Energy: 1.0312817631822342
Energy: 1.0526393449343077
Energy: 1.0001420697307537
Energy: 1.0096153837773008
Energy: 1.050220386567769
Energy: 0.9959945285289121
Energy: 1.0035288982355377
Energy: 1.0703116233250252
Energy: 0.9958058845537101
Energy: 1.0702400126520228
Energy: 0.9962935422468469
Energy: 0.9961975295361191
Energy: 1.0713033902964018
Energy: 0.9939995609281091
Energy: 1.0000028346578662
Energy: 1.0836459176289213
Energy: 1.0087193728517765
Energy: 0.9993943515633364
Energy: 1.052009716644845
Energy: 1.0121711595020988
Energy: 0.9993922121595671
Energy: 1.0267043734626031
Energy: 1.0083072152182202
Energy: 1.00453270420353
Energy: 0.9887572856968841
Energy: 1.009134695134463
Energy: 1.0006669615696657
Energy: 1.0270286753081557
Energy: 1.0078957594492626
Energy: 1.005302889207192
Energy: 1.0275432770211679
Energy: 1.0096563974613773
Energy: 1.0006735149496433
Energy: 1.0865786882496207
Energy: 1.0022073358640633
Energy: 1.0084460486330524
Energy: 1.05177679197371
Energy: 1.012081263178921
Energy: 1.0208957181812932
Energy: 1.1005885315425357
Energy: 1.019838569277071
Energy: 1.019282343099851
Energy: 1.100493202151308
Energy: 0.991052044521674
Energy: 1.0774609549339023
Energy: 1.0563039453223837
Energy: 1.0081209961463167
Energy: 1.0112281583769127
Energy: 1.0509474773987653
Energy: 1.0078963791766833
Energy: 1.0258120081158222
Energy: 1.0182488661769986
Energy: 1.000680985459424
Energy: 1.0037618598320204
Energy: 0.992069074412751
Energy: 1.0043196245177248
Energy: 1.006733212779678
Energy: 1.065804317025718
Energy: 1.0051259686806633
Energy: 1.0116363560250914
Energy: 1.0474334527401672
Energy: 1.0076744098858552
Energy: 1.0151928602679814
Energy: 1.062281106090544
Energy: 0.9977272554343188
Energy: 1.0010623802434222
Energy: 1.0600841070283726
Energy: 0.9925683677105022
Energy: 1.003113134748569
Energy: 1.0459400828805074
Energy: 0.9930201265480889
Energy: 0.994996337627833
Energy: 1.046660218530527
Energy: 1.0024117874311829
Energy: 0.9948000182796237
Energy: 1.0350139992668344
Energy: 1.0883346702151635
Energy: 1.0758856952279467
Energy: 0.99451050529944
Energy: 1.09274723533939
Energy: 0.9947391478037563
Energy: 1.019235524051898
Energy: 1.020430584257709
Energy: 0.9947948689491429
Energy: 1.019601855834301
Energy: 1.0228319636027465
Energy: 0.9945147510173916
Energy: 1.0275536002813264
Energy: 0.9977395324750233
Energy: 0.9972839173869185
Energy: 1.0268540500681045
Energy: 0.9975883361235941
Energy: 1.0038430716344624
Energy: 1.1381355136403877
Energy: 0.9985798815997481
Energy: 0.9903573095860472
Energy: 1.0253443839790493
Energy: 0.9972682700003682
Energy: 1.0204213191721923
Energy: 1.0899347850527683
Energy: 1.0292145120765428
Energy: 1.024200542642607
Energy: 1.0351441887715496
Energy: 1.023887572498941
Energy: 1.0066064365982181
Energy: 1.0966791692812432
Energy: 1.0287381401294216
Energy: 1.003446421963984
Energy: 0.9923477507002874
Energy: 1.0249975584236284
Energy: 1.022188895141956
Energy: 1.1255692149184964
Energy: 1.0227966754578537
Energy: 1.008844592583674
Energy: 1.0214714461796026
Energy: 1.0197713744874006
Energy: 0.9951693001836228
Energy: 1.0973113606056004
Energy: 0.9941252821292798
Energy: 0.9937834997523783
Energy: 1.0465805534053543
Energy: 0.9936467232873106
Energy: 1.0050078687777635
Energy: 1.0089121014720546
Energy: 1.009619974897517
Energy: 1.0016035588884824
Energy: 1.0024007379625701
Energy: 1.0403879240089369
Energy: 0.9981629767966429
Energy: 1.0078921247898378
Energy: 1.059615881153453
Energy: 1.0206413392659577
Energy: 0.9924753614673405
Energy: 1.0576134643792827
Energy: 1.0024765442048325
Energy: 1.010044229643086
Energy: 1.0195610384186007
Energy: 0.9983966520710255
Energy: 1.0098254510566842
Energy: 1.047764527448004
Energy: 0.9970219445443995
Energy: 1.2123193081902968
Energy: 0.9913830903798451
Energy: 0.9913980994347926
Energy: 1.0047371435778347
Energy: 0.9919479214152944
Energy: 0.991046625666247
Energy: 1.198132122602075
Energy: 1.042704496697357
Energy: 1.0322524751055615
Energy: 1.009830716995828
Energy: 1.051753076876007
Energy: 1.0117860355702306
Energy: 1.0416064992497214
Energy: 1.0665890196732883
Energy: 1.012019475988846
Energy: 0.9966063160992914
Energy: 1.1009392325399938
Energy: 1.0331421413972222

minimum gb energy = 0.9887572856968841 eV
minimum distance =  2.34720702266201 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.371336786893277
Energy: 1.117958381435588
Energy: 1.2205869364220938
Energy: 1.2201122127753208
Energy: 1.0231606714077355
Energy: 1.2229802809911114
Energy: 1.0755915865091126
Energy: 1.0250697504582276
Energy: 1.025116589156507
Energy: 1.0231160190309068
Energy: 1.025409279506566
Energy: 0.9753497520075319
Energy: 1.1503156762245694
Energy: 0.9742188741494349
Energy: 0.9733566158154393
Energy: 1.1479446677858798
Energy: 0.9713037832865797
Energy: 1.0241627835848006
Energy: 1.0223183757145162
Energy: 1.0255783602440742
Energy: 1.0238241261614398
Energy: 1.0232019402297698
Energy: 0.972978885554483
Energy: 1.0233053773420329
Energy: 1.0221904093859462
Energy: 1.0235990631442848
Energy: 1.024486264208001
Energy: 0.975494537193289
Energy: 1.0231483676632316
Energy: 1.0237301594138029
Energy: 1.022844859491982
Energy: 1.0437225215745278
Energy: 0.9745282792742364
Energy: 0.9762837820298794
Energy: 1.1044345716530541
Energy: 0.9761592357912244
Energy: 1.102610205546287
Energy: 0.956249495491491
Energy: 0.9563861764219281
Energy: 1.103632808558689
Energy: 0.9558471298793915
Energy: 0.9747228514205868
Energy: 1.1490378950702993
Energy: 1.0240518184438447
Energy: 1.0245836837422728
Energy: 1.0240143361268348
Energy: 1.0430307473539877
Energy: 0.9745565725841051
Energy: 1.0750077469467911
Energy: 1.0243724241335026
Energy: 0.9568800351351139
Energy: 0.9556767151265186
Energy: 1.0229706860048022
Energy: 0.9559467743810736
Energy: 1.0750190084606315
Energy: 1.024365179055052
Energy: 0.9566596160058052
Energy: 0.956321464294968
Energy: 1.023826032212488
Energy: 0.9559264749772828
Energy: 1.1492363996732735
Energy: 1.02385468679845
Energy: 1.0249838993596443
Energy: 1.0235947937121366
Energy: 1.0233341690655782
Energy: 0.9745584132110734
Energy: 1.0234289079228125
Energy: 0.9730785513121559
Energy: 0.9727457364178067
Energy: 1.0223352109552915
Energy: 0.9713010953821978
Energy: 1.0248680586309369
Energy: 1.0234041639878793
Energy: 1.0239597512412335
Energy: 0.9750813609904326
Energy: 1.0230223147877455
Energy: 1.0231092520173988
Energy: 0.9739204076270449
Energy: 1.0223308554336314
Energy: 1.024664074035749
Energy: 1.0236302049170516
Energy: 0.9760681741278159
Energy: 1.147291137243921
Energy: 1.0235204262920072
Energy: 1.046036523180954
Energy: 0.955912683652268
Energy: 0.9908143670030569
Energy: 1.0434251737084652
Energy: 0.9571006754124347
Energy: 0.9750786582666238
Energy: 1.1485027617421315
Energy: 0.955607931372195
Energy: 0.9557195020618875
Energy: 1.1482168936619255
Energy: 0.95765650475105
Energy: 1.0231602796274617
Energy: 1.0756284355501249
Energy: 1.0242278412213304
Energy: 1.0246680880518027
Energy: 1.0398778631693792
Energy: 1.0261328306445336
Energy: 0.9763413563758748

minimum gb energy = 0.955607931372195 eV
minimum distance =  2.36503674308928 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.5605109459433628
Energy: 1.144538484856467
Energy: 1.418307250023527
Energy: 1.1012392641126751
Energy: 1.2089384990902114
Energy: 1.1061856377336885
Energy: 1.1769566700062677
Energy: 1.1190860170442085
Energy: 1.1173302535309444
Energy: 1.0499122879958975
Energy: 1.1261609567483413
Energy: 1.094258471859143
Energy: 1.185762020020683
Energy: 1.0490962557176036
Energy: 1.1104640741607568
Energy: 1.1324850778223956
Energy: 1.068390364564902
Energy: 1.1607104658788592
Energy: 1.0542364131000044
Energy: 1.0939832243841467
Energy: 1.093408945733287
Energy: 1.0766134793966
Energy: 1.093252184814731
Energy: 1.0863292041733463
Energy: 1.0561746773266973
Energy: 1.109209908781002
Energy: 1.108169640492873
Energy: 1.0473000438588658
Energy: 1.1374789929284566
Energy: 1.1109315474829746
Energy: 1.0863714101085435
Energy: 1.0799554915665102
Energy: 1.0753489175309212
Energy: 1.08337292299918
Energy: 1.072358115469488
Energy: 1.068443911682215
Energy: 1.097418099174471
Energy: 1.034437005419075
Energy: 1.0372713316289712
Energy: 1.088441172640328
Energy: 1.0483662070247837
Energy: 1.085897795213546
Energy: 1.1833828959470785
Energy: 1.0751290514047573
Energy: 1.0765019740265034
Energy: 1.0681655793283102
Energy: 1.0865156853446345
Energy: 1.0906797195988507
Energy: 1.1699722908560009
Energy: 1.1181256878131656
Energy: 1.0782834609469143
Energy: 1.0475374936327662
Energy: 1.117393049063598
Energy: 1.1234755929626121
Energy: 1.1699440684545952
Energy: 1.1020355136230882
Energy: 1.1031928901390367
Energy: 1.0673805185900225
Energy: 1.103573451805849
Energy: 1.1092975495707371
Energy: 1.1662900384310253
Energy: 1.097857234227218
Energy: 1.093608589423142
Energy: 1.0693382555173576
Energy: 1.0899321339173595
Energy: 1.093872698207709
Energy: 1.1622950433075394
Energy: 1.048883588053086
Energy: 1.052616675463364
Energy: 1.1374176213482488
Energy: 1.0525077421363644
Energy: 1.113263927931116
Energy: 1.2000072360803509
Energy: 1.1088758923321038
Energy: 1.133719463049572
Energy: 1.0546179878872128
Energy: 1.1010685392304447
Energy: 1.1652751863601598
Energy: 1.2119712813785923
Energy: 1.08209510338394
Energy: 1.1321490763320783
Energy: 1.0590991263565557
Energy: 1.1116759580814957
Energy: 1.0873516655197366
Energy: 1.1419890688114653
Energy: 1.0736633542627558
Energy: 1.073392754571842
Energy: 1.1429660118453566
Energy: 1.0537502453956706
Energy: 1.105291270609338
Energy: 1.1219536709057851
Energy: 1.0812699437831332
Energy: 1.0855179913882733
Energy: 1.1223286817619358
Energy: 1.0757935239523755
Energy: 1.0852320925890342
Energy: 1.094219511993617
Energy: 1.103263081727638
Energy: 1.0876057404422959
Energy: 1.095105652826397
Energy: 1.0565068356327751
Energy: 1.1015851648064934
Energy: 1.1338107719951875
Energy: 1.1014864600001424
Energy: 1.1522995860123793
Energy: 1.1266016020217824
Energy: 1.180111432546533
Energy: 1.1532695967145448
Energy: 1.160909615398843
Energy: 1.0708879784206964
Energy: 1.1289099913379534
Energy: 1.1157501284977647
Energy: 1.062991230328144
Energy: 1.1340057134063066
Energy: 1.136274003230051
Energy: 1.0715965873041529
Energy: 1.0880580770098043
Energy: 1.1012766789997317
Energy: 1.0704681086384746
Energy: 1.1352386698001922
Energy: 1.1510019274013636
Energy: 1.1273900586996923
Energy: 1.1185386069873122
Energy: 1.065634154287128
Energy: 1.141504063597612
Energy: 1.1211664206404994

minimum gb energy = 1.034437005419075 eV
minimum distance =  2.308617332895 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.0694128413345756
Energy: 1.1344468608463432
Energy: 1.0514767613998075
Energy: 1.0707396344481275
Energy: 1.4813751010866276
Energy: 1.0639573317659103
Energy: 1.0759043209346009
Energy: 1.1090780422313944
Energy: 1.1070449389687556
Energy: 1.0016915292144934
Energy: 1.109791179314092
Energy: 1.0547623855438364
Energy: 1.0661810449180675
Energy: 1.0059728915338022
Energy: 1.0047799267770676
Energy: 1.0660937302258389
Energy: 0.9952807217293465
Energy: 1.0055100000112231
Energy: 1.098396872310502
Energy: 1.0564545407915276
Energy: 1.0538933467159446
Energy: 1.0970625881236389
Energy: 1.026739967811438
Energy: 1.0539963842733617
Energy: 0.993369167462229
Energy: 1.076557211440261
Energy: 0.9970040569553816
Energy: 0.9932661365145666
Energy: 1.0779470024197642
Energy: 0.9977375086556073
Energy: 1.07510231263048
Energy: 1.0560909295570495
Energy: 1.0537623700546452
Energy: 1.0762470633933063
Energy: 1.0797026105774312
Energy: 1.0540835807493116
Energy: 1.1386029434817129
Energy: 0.9926546660032471
Energy: 0.9937260496451727
Energy: 1.1395543149220255
Energy: 0.9928275337000747
Energy: 0.9957436410366991
Energy: 1.1397530804380736
Energy: 1.0234716025284738
Energy: 1.0877705353108207
Energy: 1.0749563890533622
Energy: 1.023617676090218
Energy: 1.1056492562833233
Energy: 1.2144611625771655
Energy: 1.0066216286184846
Energy: 1.0058925001764707
Energy: 0.9997837250909039
Energy: 1.007593270400068
Energy: 1.0053856185489016
Energy: 1.2143793721381155
Energy: 1.0903909856220984
Energy: 1.0323081641012337
Energy: 0.9999908759647039
Energy: 1.0895450378030906
Energy: 1.0399029983540506
Energy: 1.1395668138004218
Energy: 1.0010900567483203
Energy: 1.0018091672666483
Energy: 1.0755929531517916
Energy: 0.9942145477327292
Energy: 1.074834166615949
Energy: 1.1396578101252188
Energy: 1.0272176340550216
Energy: 1.0273841934784207
Energy: 1.0756474224827322
Energy: 1.0756937524240953
Energy: 1.0291340067448669
Energy: 0.9931477443766057
Energy: 1.0945669564189566
Energy: 1.024800612392707
Energy: 0.9916876477050347
Energy: 1.1396705797429258
Energy: 0.9931229479277918
Energy: 0.9928095510793248
Energy: 1.076657213267422
Energy: 1.075206463784918
Energy: 0.9931967502585294
Energy: 1.0790343625342524
Energy: 1.0248823383176737
Energy: 1.1144247731126773
Energy: 1.0015120425875175
Energy: 1.0388994210988982
Energy: 1.1137831114127072
Energy: 1.000175546430876
Energy: 1.0285428430936918
Energy: 1.0749163371535404
Energy: 1.020713223093606
Energy: 1.005749792761995
Energy: 1.0756670156799928
Energy: 1.0006198633575742
Energy: 1.0282055264454804
Energy: 0.9919335061559829
Energy: 1.0943123089971831
Energy: 1.095308061727878
Energy: 0.9925946624728708
Energy: 1.0935500834295242
Energy: 1.1075168811869072
Energy: 0.9994504801994881
Energy: 1.0771002071633067
Energy: 1.0297932829504157
Energy: 1.000424538444242
Energy: 1.0760727116040683
Energy: 1.0283830130825513
Energy: 1.1430676165177505
Energy: 0.9952685785846461
Energy: 0.9931090751585666
Energy: 1.1444709231101577
Energy: 0.9928638544862581
Energy: 1.0245714740032712
Energy: 1.141424970985271
Energy: 0.9956030882825929
Energy: 1.0235334119974122
Energy: 1.075275190122444
Energy: 0.9927973375991302
Energy: 1.0245533119964318
Energy: 1.111034741641538
Energy: 1.0391245771657667
Energy: 1.0542240983479179
Energy: 1.0004520694952388
Energy: 1.0393064426653549
Energy: 1.0541345492766712
Energy: 0.9966020695236381
Energy: 1.0654713637727313
Energy: 1.0666991186448165
Energy: 0.9975191425824758
Energy: 1.0648612038574143
Energy: 1.0649468240643105
Energy: 1.1403474794490163
Energy: 1.0011498453011423
Energy: 1.0281210642349068
Energy: 1.1099448688693514
Energy: 1.0021219174569158
Energy: 1.1063899629484146
Energy: 1.1418582609105619
Energy: 0.997105132946019
Energy: 0.9974573865644956
Energy: 1.1402904839638246
Energy: 1.0317276476700659
Energy: 0.9973277785589313
Energy: 0.9925591430048627
Energy: 1.0947856349103824
Energy: 1.0956683312381295
Energy: 0.9935491174411499
Energy: 1.0951749122596013
Energy: 1.0249928788368035

minimum gb energy = 0.9916876477050347 eV
minimum distance =  2.33249545560484 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.1542016505944188
Energy: 1.1249322193392322
Energy: 1.1048337021829342
Energy: 1.0431117638731047
Energy: 1.0619045208823261
Energy: 1.1047972664832935
Energy: 1.1265142889209412
Energy: 1.0555275354309321
Energy: 1.0532071315905187
Energy: 1.0517350674364745
Energy: 1.0501867403598601
Energy: 1.062182511327849
Energy: 1.1414743513908958
Energy: 1.043646373625815
Energy: 1.0388742501625046
Energy: 1.1413698137071429
Energy: 1.0347372648269308
Energy: 1.0647336568696775
Energy: 1.1357038244043671
Energy: 1.0548217055399907
Energy: 1.0540301807452375
Energy: 1.0690113942328767
Energy: 1.0492303398560665
Energy: 1.0538084254759694
Energy: 1.0516975080697952
Energy: 1.1003659084362487
Energy: 1.0731985735505334
Energy: 1.052596669731156
Energy: 1.1352631644898796
Energy: 1.0635740975010124
Energy: 1.0620601542506785
Energy: 1.0545437881173763
Energy: 1.0549936702267
Energy: 1.0486929575854154
Energy: 1.0546845602507764
Energy: 1.0608014601187707
Energy: 1.0600375165423603
Energy: 1.0554620513958912
Energy: 1.069301757174894
Energy: 1.0922544086644668
Energy: 1.0618498558066718
Energy: 1.0709335117494732
Energy: 1.0844350193483319
Energy: 1.0433729923096589
Energy: 1.0603671017851681
Energy: 1.0934014867586832
Energy: 1.0414755077247742
Energy: 1.0624835237313777
Energy: 1.0343702394195402
Energy: 1.036860762069811
Energy: 1.038024752771591
Energy: 1.039823512785326
Energy: 1.0685452284453663
Energy: 1.0380836959038553
Energy: 1.0421481327486455
Energy: 1.0618508796112778
Energy: 1.057015423817557
Energy: 1.0465824610005297
Energy: 1.0840929529682284
Energy: 1.045317486429567
Energy: 1.276838312700819
Energy: 1.0123042656467258
Energy: 1.012061546425619
Energy: 1.2774955259087835
Energy: 1.0115621577120073
Energy: 1.0530179662530827
Energy: 1.1253913991949407
Energy: 1.0580004731169843
Energy: 1.0398665185738207
Energy: 1.0605924726053861
Energy: 1.047666066125376
Energy: 1.0457755099124546
Energy: 1.089816846260021
Energy: 1.087328601469329
Energy: 1.0523871789182766
Energy: 1.0479195001220425
Energy: 1.086596598396276
Energy: 1.0411371957051723
Energy: 1.1583737632304676
Energy: 1.0484305856988765
Energy: 1.0541842566665167
Energy: 1.0214720732948634
Energy: 1.0482132832996989
Energy: 1.057431358612562
Energy: 1.1258114574934184
Energy: 1.0119250065518952
Energy: 1.009478367432017
Energy: 1.083755164758757
Energy: 1.023048783355904
Energy: 1.009170062567771
Energy: 1.1696447475690142
Energy: 1.043343179096405
Energy: 1.036545109135203
Energy: 1.0634445144368556
Energy: 1.022966450879865
Energy: 1.037607077543686
Energy: 1.047568024639056
Energy: 1.0664755435925366
Energy: 1.0579600817394732
Energy: 1.0117785703726243
Energy: 1.0827943424475857
Energy: 1.0556534598453204
Energy: 1.1378600641085193
Energy: 1.0555661324423937
Energy: 1.0513876168401626
Energy: 1.017285512534718
Energy: 1.054977069528217
Energy: 1.0487160652695122
Energy: 1.1083826189759358
Energy: 1.0268754467185153
Energy: 1.0207492334504769
Energy: 1.0972769683273553
Energy: 1.020446536692921
Energy: 1.0527847167749844
Energy: 1.0228149382617509
Energy: 1.0370609317864001
Energy: 1.0313589593544648
Energy: 1.034652603149156
Energy: 1.020481859499765
Energy: 1.040163431615341
Energy: 1.0259619984705666
Energy: 1.0729748259895355
Energy: 1.0471680510743016
Energy: 1.027612547227692
Energy: 1.0412829809798327
Energy: 1.0166879116624616
Energy: 1.020181359061982
Energy: 1.0622766793481213
Energy: 1.0495339643416082
Energy: 1.0204455265855703
Energy: 1.0572721359476018
Energy: 1.0429399176916059
Energy: 1.1040952521665683
Energy: 1.0277006721564845
Energy: 1.034953614218615
Energy: 1.0929735602008537
Energy: 1.0460124919160927
Energy: 1.048081207278562
Energy: 1.1155277827125094
Energy: 1.0449604925599378
Energy: 1.0450056092322353
Energy: 1.0885730148931618
Energy: 1.0170495761648513
Energy: 1.0454137902077922
Energy: 1.0959413675674359
Energy: 1.0468009753166194
Energy: 1.0537370693353274
Energy: 1.0213076232943672
Energy: 1.06049888772984
Energy: 1.0405279612378808
Energy: 1.0487422199045962
Energy: 1.0713325888199186
Energy: 1.0697073342168266
Energy: 1.0352160977098732
Energy: 1.0696910523201044
Energy: 1.0468971610034659
Energy: 1.1270427937396357
Energy: 1.0492813676976178
Energy: 1.048559479771868
Energy: 1.08326032098719
Energy: 1.0431898373707003
Energy: 1.053191887428367
Energy: 1.1229418875498356
Energy: 1.0389873017004656
Energy: 1.041488250574959
Energy: 1.0864126865830819
Energy: 1.0375471334250035
Energy: 1.0454276536738478
Energy: 1.1337243873821594
Energy: 1.073031733592222
Energy: 1.0741122250580954
Energy: 1.0142475891775917
Energy: 1.072522391759766
Energy: 1.04201549273078

minimum gb energy = 1.009170062567771 eV
minimum distance =  2.30854709688626 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.4860556591518508
Energy: 1.0954009066087518
Energy: 1.040984997391874
Energy: 1.0307152504816726
Energy: 1.036745536830508
Energy: 1.0302299815379874
Energy: 1.1142933520257126
Energy: 1.0020685048376372
Energy: 1.0040475293199964
Energy: 0.9943752549718031
Energy: 1.0032442005268878
Energy: 0.9931090852095369
Energy: 1.072549805702424
Energy: 0.9899385846724714
Energy: 0.98912336819954
Energy: 1.0336994375513653
Energy: 0.9960002003385261
Energy: 0.9932938163426374
Energy: 1.0433121397446374
Energy: 0.995496015859129
Energy: 0.9927649639785113
Energy: 1.0010353948188808
Energy: 0.9935726477202775
Energy: 0.9924638767212436
Energy: 1.0159452463432157
Energy: 1.0481598832970396
Energy: 1.0559433554547775
Energy: 1.0156623051312577
Energy: 1.0567927851499557
Energy: 1.0480148880768794
Energy: 1.0568047975371642
Energy: 0.9956556325709787
Energy: 0.9941333765746991
Energy: 1.0274929866445905
Energy: 1.002993460432368
Energy: 1.0003295829560739
Energy: 1.0693383048412968
Energy: 0.9967272507551987
Energy: 0.9985763075259114
Energy: 1.0428988092008906
Energy: 0.9876510920211179
Energy: 1.0230892714054411
Energy: 1.024262693944066
Energy: 0.9988359362563684
Energy: 0.9985193363818528
Energy: 1.0265294791517916
Energy: 0.9908014295836453
Energy: 1.0006856664048247
Energy: 0.9942155057898997
Energy: 0.9920545021211973
Energy: 1.0013912774622198
Energy: 0.995750371148942
Energy: 1.0178037618210607
Energy: 1.0008699374891357
Energy: 1.0010111981896965
Energy: 1.000299565757765
Energy: 0.9947238048431616
Energy: 1.0174890806875934
Energy: 0.9975803848039164
Energy: 0.9976092100785241
Energy: 1.1766832446799815
Energy: 0.9635802493210845
Energy: 1.0309730770108467
Energy: 1.177474705924776
Energy: 0.9631172691783421
Energy: 1.0297226095711947
Energy: 1.104128835716442
Energy: 0.9968219072357715
Energy: 0.9975223476398877
Energy: 0.9961578919696472
Energy: 0.9936911245865705
Energy: 0.9979579315224693
Energy: 1.0249509587108796
Energy: 1.0364875261885842
Energy: 1.00352841018792
Energy: 0.9950987599248379
Energy: 1.0636756225112298
Energy: 1.0022062358341088
Energy: 1.0227602565832083
Energy: 0.9990742834186185
Energy: 0.9978705784347207
Energy: 0.9974935433750675
Energy: 0.99724459668344
Energy: 0.9974046905492396
Energy: 1.0721183934839016
Energy: 1.00118460441141
Energy: 0.9988217290340942
Energy: 1.0314439975044054
Energy: 1.0046507356810364
Energy: 1.0084593912633946
Energy: 1.0720453181359921
Energy: 0.9918740782760365
Energy: 0.9942591799522691
Energy: 0.9988060758885502
Energy: 0.9973344716711925
Energy: 0.9930715883995619
Energy: 1.026858134059469
Energy: 1.0524128160700421
Energy: 0.9960750553376797
Energy: 0.9627568408811902
Energy: 1.0540235418691615
Energy: 0.9626642090000954
Energy: 1.172689239538003
Energy: 1.000034559773063
Energy: 1.0004563278970853
Energy: 0.9994669902892209
Energy: 1.0003446383603654
Energy: 0.9944654905876433
Energy: 1.0803613147032594
Energy: 0.9914011979284489
Energy: 0.9969926136981079
Energy: 1.0339491594700623
Energy: 0.9930523570691633
Energy: 0.9979944668050318
Energy: 1.0960524554546935
Energy: 0.9922917273598257
Energy: 0.9979446554001358
Energy: 1.0015009051178327
Energy: 0.9930643311371034
Energy: 1.0037918672090194
Energy: 1.023542211816506
Energy: 1.026585308584772
Energy: 1.0041150415344788
Energy: 1.0169584995893044
Energy: 1.026398157546791
Energy: 0.9981349371879592
Energy: 1.028547472978389
Energy: 1.0036606766259968
Energy: 0.9994127064707223
Energy: 1.020702109848335
Energy: 1.0014180584944776
Energy: 0.9965052447061291
Energy: 1.0537456437421997
Energy: 0.9957558101059591
Energy: 0.9885618694033967
Energy: 1.0513455919498715
Energy: 0.9941444855790703
Energy: 0.9883417083082728
Energy: 1.0237256468133202
Energy: 0.9916500191811795
Energy: 0.9914189299477764
Energy: 1.0256057592753345
Energy: 0.9946240460584976
Energy: 1.0498243358450872
Energy: 0.9981279462304129
Energy: 1.003726275338387
Energy: 1.0004986883885252
Energy: 0.9985165080724312
Energy: 1.0037443919737021
Energy: 0.9972800139682623
Energy: 0.9999058904139995
Energy: 1.0021913635431414
Energy: 0.9958320968725579
Energy: 1.000278695526451
Energy: 0.9973867172385779
Energy: 0.9968846029540939
Energy: 1.0370988238010557
Energy: 0.9633379445333794
Energy: 0.9717923168603843
Energy: 1.0278965429095215
Energy: 0.9755163237605781
Energy: 0.988294297650989
Energy: 1.101368330172668
Energy: 0.9872303309877705
Energy: 0.9886438979695957
Energy: 0.9971685361113277
Energy: 0.9653555228906257
Energy: 0.9967263888191309
Energy: 1.023537758342507
Energy: 0.997954771534488
Energy: 0.9971044355234413
Energy: 0.9992923280577334
Energy: 0.9877760338835864
Energy: 0.9963081394202501
Energy: 1.0223470920806959
Energy: 0.9909674714298938
Energy: 0.9933180083784601
Energy: 0.9974378807842009
Energy: 0.9929372992405119
Energy: 0.9918406265579628
Energy: 1.1022335989022536
Energy: 0.9977069713601855
Energy: 1.0022366020983917
Energy: 0.997727652838512
Energy: 1.0037402200530112
Energy: 0.9960006765683641
Energy: 1.0742507146802869
Energy: 0.9923372207673014
Energy: 1.000000662069072
Energy: 1.0211145828675232
Energy: 0.9962860940012072
Energy: 0.9905645260758869
Energy: 1.0270347924548977
Energy: 1.0428849577967205
Energy: 0.998456322753943
Energy: 0.9782523003436613
Energy: 1.0428031839759648
Energy: 0.9972203237113657

minimum gb energy = 0.9626642090000954 eV
minimum distance =  2.31356839495769 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.015356886046272077
Energy: 0.015985084675497023
Energy: 0.01601651775110799
Energy: 0.01697998946631052
Energy: 0.8904219849834636
Energy: 0.015908281505246636
Energy: 0.015837604039198552
Energy: 0.1117633133965139
Energy: 0.11046330191973756
Energy: 0.11025269901979562
Energy: 0.11278210831705134
Energy: 0.11009015896097765
Energy: 1.165675042948793
Energy: 0.8892474388433311
Energy: 0.8894049603136843
Energy: 0.888087909013273
Energy: 0.8873938208758988
Energy: 0.8886768853069721
Energy: 0.3793887121735609
Energy: 0.1117633133965139
Energy: 0.11046330192059994
Energy: 0.11025269901979562
Energy: 0.11278210831747021
Energy: 0.1100901589622589

minimum gb energy = 0.015356886046272077 eV
minimum distance =  2.52668660926455 Angstroms
sigma value = 1